methyl 2-[[1-(3-methylphenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[1-(3-methylphenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[1-(m-tolyl)-4-oxo-pyridazine-3-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[1-(3-methylphenyl)-4-oxo-3-pyridazinyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(3-methylphenyl)-4-oxopyridazine-3-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[4-keto-1-(m-tolyl)pyridazine-3-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC(=O)C(=N2)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC(=O)C(=N2)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)OC

InChI

InChI=1S/C21H19N3O4S/c1-12-5-3-6-13(11-12)24-10-9-15(25)18(23-24)19(26)22-20-17(21(27)28-2)14-7-4-8-16(14)29-20/h3,5-6,9-11H,4,7-8H2,1-2H3,(H,22,26)