[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone

Systemtic Name: [4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(3-methoxybenzoyl)piperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone CAS Name: [4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-[4-[(methylthio)methyl]phenyl]methanone IUPAC Name: [4-(3-methoxybenzoyl)piperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Traditional Name: (4-m-anisoylpiperazino)-[4-[(methylthio)methyl]phenyl]methanone Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC

InChI

InChI=1S/C21H24N2O3S/c1-26-19-5-3-4-18(14-19)21(25)23-12-10-22(11-13-23)20(24)17-8-6-16(7-9-17)15-27-2/h3-9,14H,10-13,15H2,1-2H3