3-(2-methylpropyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-[4-(2-methylthiazol-4-yl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-N-[4-(2-methyl-4-thiazolyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-[4-(2-methylthiazol-4-yl)phenyl]phthalazine-1-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC(C)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC(C)C

InChI

InChI=1S/C23H22N4O2S/c1-14(2)12-27-23(29)19-7-5-4-6-18(19)21(26-27)22(28)25-17-10-8-16(9-11-17)20-13-30-15(3)24-20/h4-11,13-14H,12H2,1-3H3,(H,25,28)