(2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide

Systemtic Name: (2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide Openeye Name: (2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-3-(1-methylpyrrol-2-yl)propanamide CAS Name: (2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-3-(1-methyl-2-pyrrolyl)propanamide IUPAC Name: (2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide Traditional Name: (2S)-2-acetamido-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-3-(1-methylpyrrol-2-yl)propionamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C(CC3=CC=CN3C)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)[C@H](CC3=CC=CN3C)NC(=O)C

InChI

InChI=1S/C23H31N5O5S/c1-16(29)24-18-6-8-21(9-7-18)34(32,33)28-13-10-19(11-14-28)26-23(31)22(25-17(2)30)15-20-5-4-12-27(20)3/h4-9,12,19,22H,10-11,13-15H2,1-3H3,(H,24,29)(H,25,30)(H,26,31)/t22-/m0/s1