N-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[2-(4-methoxyphenyl)-1-azepanyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-keto-3-[2-(4-methoxyphenyl)azepan-1-yl]propyl]thiophene-3-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H26N2O3S/c1-26-18-8-6-16(7-9-18)19-5-3-2-4-13-23(19)20(24)10-12-22-21(25)17-11-14-27-15-17/h6-9,11,14-15,19H,2-5,10,12-13H2,1H3,(H,22,25)