3-(2-methylpropyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(5-methyl-1,3,4-thiadiazol-2-yl)phthalazine-1-carboxamide Formula: C16H17N5O2S MolecularWeight: 343.40348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C16H17N5O2S/c1-9(2)8-21-15(23)12-7-5-4-6-11(12)13(20-21)14(22)17-16-19-18-10(3)24-16/h4-7,9H,8H2,1-3H3,(H,17,19,22)