N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-methoxy-benzamide

Systemtic Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-methoxy-benzamide Openeye Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-2-methoxy-benzamide CAS Name: N-[2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-methoxybenzamide IUPAC Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-2-methoxybenzamide Traditional Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]-2-methoxy-benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=CC=C3OC)C

InChI

InChI=1S/C22H27N3O5S/c1-16-8-9-18(14-17(16)2)31(28,29)25-12-10-24(11-13-25)21(26)15-23-22(27)19-6-4-5-7-20(19)30-3/h4-9,14H,10-13,15H2,1-3H3,(H,23,27)