methyl 2-[[4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoyl]amino]thiazole-5-carboxylate CAS Name: 2-[[1,4-dioxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butanoyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O4S/c1-26-17(25)14-11-19-18(27-14)20-15(23)7-8-16(24)22-10-9-13(21-22)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,19,20,23)