2-cyano-3-[3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-4H-pyrazol-4-yl]-3-phenyl-propanamide

Systemtic Name: 2-cyano-3-[3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-4H-pyrazol-4-yl]-3-phenyl-propanamide Openeye Name: 2-cyano-3-[3-methyl-1-[4-(3-nitrophenyl)thiazol-2-yl]-5-oxo-4H-pyrazol-4-yl]-3-phenyl-propanamide CAS Name: 2-cyano-3-[3-methyl-1-[4-(3-nitrophenyl)-2-thiazolyl]-5-oxo-4H-pyrazol-4-yl]-3-phenylpropanamide IUPAC Name: 2-cyano-3-[3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4H-pyrazol-4-yl]-3-phenylpropanamide Traditional Name: 2-cyano-3-[5-keto-3-methyl-1-[4-(3-nitrophenyl)thiazol-2-yl]-2-pyrazolin-4-yl]-3-phenyl-propionamide Formula: C23H18N6O4S MolecularWeight: 474.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(C2=CC=CC=C2)C(C#N)C(=O)N)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1C(C2=CC=CC=C2)C(C#N)C(=O)N)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N6O4S/c1-13-19(20(17(11-24)21(25)30)14-6-3-2-4-7-14)22(31)28(27-13)23-26-18(12-34-23)15-8-5-9-16(10-15)29(32)33/h2-10,12,17,19-20H,1H3,(H2,25,30)