N-(2-methylphenyl)-N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]methanesulfonamide

Systemtic Name: N-(2-methylphenyl)-N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]methanesulfonamide Openeye Name: N-(o-tolyl)-N-[2-oxo-2-[4-(3-thienylmethyl)piperazin-1-yl]ethyl]methanesulfonamide CAS Name: N-(2-methylphenyl)-N-[2-oxo-2-[4-(3-thiophenylmethyl)-1-piperazinyl]ethyl]methanesulfonamide IUPAC Name: N-(2-methylphenyl)-N-[2-oxo-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethyl]methanesulfonamide Traditional Name: N-[2-keto-2-[4-(3-thenyl)piperazino]ethyl]-N-(o-tolyl)methanesulfonamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)C

InChI

InChI=1S/C19H25N3O3S2/c1-16-5-3-4-6-18(16)22(27(2,24)25)14-19(23)21-10-8-20(9-11-21)13-17-7-12-26-15-17/h3-7,12,15H,8-11,13-14H2,1-2H3