(phenylmethyl) N-[(2S,3S)-3-methyl-1-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S,3S)-3-methyl-1-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2S)-2-methyl-1-[[4-methyl-3-(1-piperidylsulfonyl)phenyl]carbamoyl]butyl]carbamate CAS Name: N-[(2S,3S)-3-methyl-1-[4-methyl-3-(1-piperidinylsulfonyl)anilino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3S)-3-methyl-1-(4-methyl-3-piperidin-1-ylsulfonylanilino)-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S,2S)-2-methyl-1-[(4-methyl-3-piperidinosulfonyl-phenyl)carbamoyl]butyl]carbamic acid benzyl ester Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H35N3O5S/c1-4-19(2)24(28-26(31)34-18-21-11-7-5-8-12-21)25(30)27-22-14-13-20(3)23(17-22)35(32,33)29-15-9-6-10-16-29/h5,7-8,11-14,17,19,24H,4,6,9-10,15-16,18H2,1-3H3,(H,27,30)(H,28,31)/t19-,24-/m0/s1