N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,4-dimethyl-benzamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,4-dimethyl-benzamide CAS Name: N-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]propyl]-3,4-dimethylbenzamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,4-dimethylbenzamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]sulfonylpropyl]-3,4-dimethyl-benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C23H31N3O4S/c1-18-5-6-20(17-19(18)2)23(27)24-11-4-16-31(28,29)26-14-12-25(13-15-26)21-7-9-22(30-3)10-8-21/h5-10,17H,4,11-16H2,1-3H3,(H,24,27)