N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[[4-[1-azepanyl(oxo)methyl]phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[[4-(azepane-1-carbonyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[4-(azepane-1-carbonyl)benzyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=CNC3=S

InChI

InChI=1S/C20H23N3O2S/c24-18(17-6-5-11-21-19(17)26)22-14-15-7-9-16(10-8-15)20(25)23-12-3-1-2-4-13-23/h5-11H,1-4,12-14H2,(H,21,26)(H,22,24)