ethyl 4-(4-bromophenyl)-2-[[(Z)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[[(Z)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[[(Z)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(Z)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[[(Z)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)methyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[(Z)-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)methyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H20BrN3O3S MolecularWeight: 510.4029

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC=C3C(=C)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)N/C=C\3/C(=C)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20BrN3O3S/c1-3-31-24(30)21-20(16-9-11-17(25)12-10-16)14-32-22(21)26-13-19-15(2)27-28(23(19)29)18-7-5-4-6-8-18/h4-14,26-27H,2-3H2,1H3/b19-13-