CHEBI:121366 - N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-methylbenzamide

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ChEBI Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-methylbenzamide
ChEBI ID CHEBI:121366
Stars This entity has been manually annotated by a third party.
Supplier Information eMolecules:1458238, ZINC000000567687
Download Molfile XML SDF
Formula C18H18N2OS
Net Charge 0
Average Mass 310.415
Monoisotopic Mass 310.11398
InChI InChI=1S/C18H18N2OS/c1-12-6-5-7-13(10-12)17(21)20-18-15(11-19)14-8-3-2-4-9-16(14)22-18/h5-7,10H,2-4,8-9H2,1H3,(H,20,21)
InChIKey MGTUSCSBWRYSNB-UHFFFAOYSA-N
SMILES CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C#N
ChEBI Ontology
Outgoing N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-methylbenzamide (CHEBI:121366) is a organosulfur heterocyclic compound (CHEBI:38106)
Manual Xref Database
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