4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-methylsulfanyl-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-methylsulfanyl-2-propan-2-yl-phthalazin-1-one Openeye Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-methylsulfanyl-phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(methylthio)-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-methylsulfanyl-2-propan-2-ylphthalazin-1-one Traditional Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(methylthio)phthalazin-1-one Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)SC)C(C)C

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)SC)C(C)C

InChI

InChI=1S/C16H19N5OS/c1-9(2)21-16(22)13-8-11(23-4)5-6-12(13)15(20-21)17-14-7-10(3)18-19-14/h5-9H,1-4H3,(H2,17,18,19,20)