pyridin-4-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: pyridin-4-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: 4-pyridylmethyl N-[(1S)-1-[[(1S,2R)-3-[(4-acetamidophenyl)sulfonyl-isobutyl-amino]-1-benzyl-2-hydroxy-propyl]carbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[[(2S,3R)-4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[(1S,2R)-3-[(4-acetamidophenyl)sulfonyl-isobutyl-amino]-1-benzyl-2-hydroxy-propyl]carbamoyl]-2-methyl-propyl]carbamic acid 4-pyridylmethyl ester Formula: C34H45N5O7S MolecularWeight: 667.8154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)OCC2=CC=NC=C2)O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)[C@H](C(C)C)NC(=O)OCC2=CC=NC=C2)O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C34H45N5O7S/c1-23(2)20-39(47(44,45)29-13-11-28(12-14-29)36-25(5)40)21-31(41)30(19-26-9-7-6-8-10-26)37-33(42)32(24(3)4)38-34(43)46-22-27-15-17-35-18-16-27/h6-18,23-24,30-32,41H,19-22H2,1-5H3,(H,36,40)(H,37,42)(H,38,43)/t30-,31+,32-/m0/s1