N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide CAS Name: N-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]propyl]-3,5-dimethylbenzamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethylbenzamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]sulfonylpropyl]-3,5-dimethyl-benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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