N-[4-(azepan-1-yl)phenyl]-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-4-(5-methyl-2-thienyl)-4-oxo-butanamide CAS Name: N-[4-(1-azepanyl)phenyl]-4-(5-methyl-2-thiophenyl)-4-oxobutanamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-4-keto-4-(5-methyl-2-thienyl)butyramide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H26N2O2S/c1-16-6-12-20(26-16)19(24)11-13-21(25)22-17-7-9-18(10-8-17)23-14-4-2-3-5-15-23/h6-10,12H,2-5,11,13-15H2,1H3,(H,22,25)