methyl 3-methyl-5-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-methyl-5-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-methyl-5-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OC

InChI

InChI=1S/C17H15N3O4S/c1-9-8-12(25-14(9)17(23)24-3)18-15(21)13-10-6-4-5-7-11(10)16(22)20(2)19-13/h4-8H,1-3H3,(H,18,21)