(4-nitrophenyl) 3-methyl-2-[[methyl(1,3-thiazol-4-ylmethyl)carbamoyl]amino]butanoate

Systemtic Name: (4-nitrophenyl) 3-methyl-2-[[methyl(1,3-thiazol-4-ylmethyl)carbamoyl]amino]butanoate Openeye Name: (4-nitrophenyl) 3-methyl-2-[[methyl(thiazol-4-ylmethyl)carbamoyl]amino]butanoate CAS Name: 3-methyl-2-[[[methyl(4-thiazolylmethyl)amino]-oxomethyl]amino]butanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-methyl-2-[[methyl(1,3-thiazol-4-ylmethyl)carbamoyl]amino]butanoate Traditional Name: 3-methyl-2-[[methyl(thiazol-4-ylmethyl)carbamoyl]amino]butyric acid (4-nitrophenyl) ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N(C)CC2=CSC=N2

Isomeric SMILES

CC(C)C(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N(C)CC2=CSC=N2

InChI

InChI=1S/C17H20N4O5S/c1-11(2)15(19-17(23)20(3)8-12-9-27-10-18-12)16(22)26-14-6-4-13(5-7-14)21(24)25/h4-7,9-11,15H,8H2,1-3H3,(H,19,23)