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

Systemtic Name: [4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(3-methoxybenzoyl)piperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone CAS Name: [4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone IUPAC Name: [4-(3-methoxybenzoyl)piperazin-1-yl]-[4-(phenylsulfanylmethyl)phenyl]methanone Traditional Name: (4-m-anisoylpiperazino)-[4-[(phenylthio)methyl]phenyl]methanone Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O3S/c1-31-23-7-5-6-22(18-23)26(30)28-16-14-27(15-17-28)25(29)21-12-10-20(11-13-21)19-32-24-8-3-2-4-9-24/h2-13,18H,14-17,19H2,1H3