ethyl 3-azanyl-4-[[4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,3-thiazol-2-yl]carbamoyl]-5-phenylazanyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-[[4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,3-thiazol-2-yl]carbamoyl]-5-phenylazanyl-thiophene-2-carboxylate Openeye Name: ethyl 3-amino-5-anilino-4-[[4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiazol-2-yl]carbamoyl]thiophene-2-carboxylate CAS Name: 3-amino-5-anilino-4-[[[4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-thiazolyl]amino]-oxomethyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-anilino-4-[[4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-thiazol-2-yl]carbamoyl]thiophene-2-carboxylate Traditional Name: 3-amino-5-anilino-4-[[4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiazol-2-yl]carbamoyl]thiophene-2-carboxylic acid ethyl ester Formula: C28H26N6O4S2 MolecularWeight: 574.67384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C)N

InChI

InChI=1S/C28H26N6O4S2/c1-4-38-27(37)23-22(29)21(25(40-23)30-17-11-7-5-8-12-17)24(35)32-28-31-19(15-39-28)20-16(2)33(3)34(26(20)36)18-13-9-6-10-14-18/h5-15,30H,4,29H2,1-3H3,(H,31,32,35)