(2S,3S)-2-(aminocarbonylamino)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-methyl-pentanamide

Systemtic Name: (2S,3S)-2-(aminocarbonylamino)-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-methyl-pentanamide Openeye Name: (2S,3S)-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-3-methyl-2-ureido-pentanamide CAS Name: (2S,3S)-2-(carbamoylamino)-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-3-methylpentanamide IUPAC Name: (2S,3S)-2-(carbamoylamino)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-3-methylpentanamide Traditional Name: (2S,3S)-N-(4-methoxy-3-piperidinosulfonyl-phenyl)-3-methyl-2-ureido-valeramide Formula: C19H30N4O5S MolecularWeight: 426.5303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)NC(=O)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)NC(=O)N

InChI

InChI=1S/C19H30N4O5S/c1-4-13(2)17(22-19(20)25)18(24)21-14-8-9-15(28-3)16(12-14)29(26,27)23-10-6-5-7-11-23/h8-9,12-13,17H,4-7,10-11H2,1-3H3,(H,21,24)(H3,20,22,25)/t13-,17-/m0/s1