(2S)-N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfonylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfonylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfonylpiperazin-1-yl)propanamide CAS Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-(4-methylsulfonyl-1-piperazinyl)propanamide IUPAC Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-(4-methylsulfonylpiperazin-1-yl)propanamide Traditional Name: (2S)-2-(4-mesylpiperazino)-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C16H25N3O4S MolecularWeight: 355.4524

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O4S/c1-12-5-6-15(23-3)14(11-12)17-16(20)13(2)18-7-9-19(10-8-18)24(4,21)22/h5-6,11,13H,7-10H2,1-4H3,(H,17,20)/t13-/m0/s1