propan-2-yl 5-[[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 5-[[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 5-[[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[4-(2-amino-2-oxoethyl)-2-thiazolyl]amino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-[[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[4-(2-amino-2-keto-ethyl)thiazol-2-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NC2=NC(=CS2)CC(=O)N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NC2=NC(=CS2)CC(=O)N

InChI

InChI=1S/C16H20N4O4S/c1-7(2)24-15(23)12-8(3)13(18-9(12)4)14(22)20-16-19-10(6-25-16)5-11(17)21/h6-7,18H,5H2,1-4H3,(H2,17,21)(H,19,20,22)