2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[4-(2,3-dimethylphenyl)piperazino]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C26H36N4O3S/c1-20-8-7-9-25(21(20)2)29-18-16-28(17-19-29)22(3)26(31)27-23-10-12-24(13-11-23)34(32,33)30-14-5-4-6-15-30/h7-13,22H,4-6,14-19H2,1-3H3,(H,27,31)