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

Systemtic Name: 5-(azepan-1-yl)-N-[(4-methoxyphenyl)methyl]-4-phenyl-thiophene-2-carboxamide Openeye Name: 5-(azepan-1-yl)-N-[(4-methoxyphenyl)methyl]-4-phenyl-thiophene-2-carboxamide CAS Name: 5-(1-azepanyl)-N-[(4-methoxyphenyl)methyl]-4-phenyl-2-thiophenecarboxamide IUPAC Name: 5-(azepan-1-yl)-N-[(4-methoxyphenyl)methyl]-4-phenylthiophene-2-carboxamide Traditional Name: 5-(azepan-1-yl)-N-p-anisyl-4-phenyl-thiophene-2-carboxamide Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=CC(=C(S2)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=CC(=C(S2)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2S/c1-29-21-13-11-19(12-14-21)18-26-24(28)23-17-22(20-9-5-4-6-10-20)25(30-23)27-15-7-2-3-8-16-27/h4-6,9-14,17H,2-3,7-8,15-16,18H2,1H3,(H,26,28)