ethyl 5-[(3,4-dichlorophenyl)carbamoylamino]-4-oxidanylidene-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 5-[(3,4-dichlorophenyl)carbamoylamino]-4-oxidanylidene-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 5-[(3,4-dichlorophenyl)carbamoylamino]-4-oxo-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 5-[[(3,4-dichloroanilino)-oxomethyl]amino]-4-oxo-3-phenyl-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3,4-dichlorophenyl)carbamoylamino]-4-oxo-3-phenylthieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 5-[(3,4-dichlorophenyl)carbamoylamino]-4-keto-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C22H16Cl2N4O4S MolecularWeight: 503.35784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H16Cl2N4O4S/c1-2-32-21(30)18-14-11-33-19(26-22(31)25-12-8-9-15(23)16(24)10-12)17(14)20(29)28(27-18)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H2,25,26,31)