CHEBI:108077 - 6-[2-(2-methoxyphenyl)imino-3-(2-oxolanylmethyl)-4-thiazolyl]-4H-1,4-benzoxazin-3-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-[2-(2-methoxyphenyl)imino-3-(2-oxolanylmethyl)-4-thiazolyl]-4H-1,4-benzoxazin-3-one
ChEBI ID CHEBI:108077
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H23N3O4S
Net Charge 0
Average Mass 437.513
Monoisotopic Mass 437.14093
InChI InChI=1S/C23H23N3O4S/c1-28-20-7-3-2-6-17(20)25-23-26(12-16-5-4-10-29-16)19(14-31-23)15-8-9-21-18(11-15)24-22(27)13-30-21/h2-3,6-9,11,14,16H,4-5,10,12-13H2,1H3,(H,24,27)
InChIKey XTOAWMVAZOOIGP-UHFFFAOYSA-N
SMILES COC1=CC=CC=C1N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC5CCCO5
ChEBI Ontology
Outgoing 6-[2-(2-methoxyphenyl)imino-3-(2-oxolanylmethyl)-4-thiazolyl]-4H-1,4-benzoxazin-3-one (CHEBI:108077) is a benzoxazine (CHEBI:46969)
Manual Xref Database
LSM-19454 LINCS
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