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

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C17H19N5O2S/c1-4-13-19-20-17(25-13)18-15(23)14-11-7-5-6-8-12(11)16(24)22(21-14)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,18,20,23)