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

Systemtic Name: ethyl 4-[3-methyl-1-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butyl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[1-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-butyl]thiazole-2-carboxylate CAS Name: 4-[3-methyl-1-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]butyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-methyl-1-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butyl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[1-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-butyl]thiazole-2-carboxylic acid ethyl ester Formula: C28H33N3O5S MolecularWeight: 523.64372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)C(CC(C)C)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)C(CC(C)C)NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H33N3O5S/c1-4-35-27(33)26-30-24(18-37-26)22(15-19(2)3)29-25(32)23(16-20-11-7-5-8-12-20)31-28(34)36-17-21-13-9-6-10-14-21/h5-14,18-19,22-23H,4,15-17H2,1-3H3,(H,29,32)(H,31,34)