5-(azepan-1-yl)-N-methyl-4-phenyl-thiophene-2-carboxamide

Systemtic Name: 5-(azepan-1-yl)-N-methyl-4-phenyl-thiophene-2-carboxamide Openeye Name: 5-(azepan-1-yl)-N-methyl-4-phenyl-thiophene-2-carboxamide CAS Name: 5-(1-azepanyl)-N-methyl-4-phenyl-2-thiophenecarboxamide IUPAC Name: 5-(azepan-1-yl)-N-methyl-4-phenylthiophene-2-carboxamide Traditional Name: 5-(azepan-1-yl)-N-methyl-4-phenyl-thiophene-2-carboxamide Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=C(S1)N2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=CC(=C(S1)N2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2OS/c1-19-17(21)16-13-15(14-9-5-4-6-10-14)18(22-16)20-11-7-2-3-8-12-20/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3,(H,19,21)