(2S)-2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide Openeye Name: (2S)-2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: (2S)-2-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-N-(2-methoxy-5-methylphenyl)propanamide IUPAC Name: (2S)-2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methoxy-5-methylphenyl)propanamide Traditional Name: (2S)-2-[4-(2-chlorophenyl)sulfonylpiperazino]-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H26ClN3O4S/c1-15-8-9-19(29-3)18(14-15)23-21(26)16(2)24-10-12-25(13-11-24)30(27,28)20-7-5-4-6-17(20)22/h4-9,14,16H,10-13H2,1-3H3,(H,23,26)/t16-/m0/s1