N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-chlorophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-chlorophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3-chlorophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-chlorophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-chlorophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3-chlorophenyl)-4-keto-pyridazine-3-carboxamide Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl)C(=O)N

InChI

InChI=1S/C20H17ClN4O3S/c21-11-4-3-5-12(10-11)25-9-8-14(26)17(24-25)19(28)23-20-16(18(22)27)13-6-1-2-7-15(13)29-20/h3-5,8-10H,1-2,6-7H2,(H2,22,27)(H,23,28)