phenyl 4-[3-methyl-1-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]butyl]-1,3-thiazole-2-carboxylate

Systemtic Name: phenyl 4-[3-methyl-1-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]butyl]-1,3-thiazole-2-carboxylate Openeye Name: phenyl 4-[1-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-3-methyl-butyl]thiazole-2-carboxylate CAS Name: 4-[3-methyl-1-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]butyl]-2-thiazolecarboxylic acid phenyl ester IUPAC Name: phenyl 4-[3-methyl-1-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]butyl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[1-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-3-methyl-butyl]thiazole-2-carboxylic acid phenyl ester Formula: C29H35N3O5S MolecularWeight: 537.6703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CSC(=N1)C(=O)OC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C1=CSC(=N1)C(=O)OC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H35N3O5S/c1-19(2)15-23(25-18-38-27(31-25)28(34)37-22-13-9-6-10-14-22)30-26(33)24(16-20(3)4)32-29(35)36-17-21-11-7-5-8-12-21/h5-14,18-20,23-24H,15-17H2,1-4H3,(H,30,33)(H,32,35)