N-[(Z)-1-(5-azanyl-3-methyl-1,2-thiazol-4-yl)ethylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(5-azanyl-3-methyl-1,2-thiazol-4-yl)ethylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(5-amino-3-methyl-isothiazol-4-yl)ethylideneamino]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(5-amino-3-methyl-4-isothiazolyl)ethylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(5-amino-3-methyl-1,2-thiazol-4-yl)ethylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(5-amino-3-methyl-isothiazol-4-yl)ethylideneamino]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)C)N

Isomeric SMILES

CC1=NSC(=C1/C(=N\NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)/C)N

InChI

InChI=1S/C18H20N6O2S/c1-9(2)24-18(26)13-8-6-5-7-12(13)15(22-24)17(25)21-20-10(3)14-11(4)23-27-16(14)19/h5-9H,19H2,1-4H3,(H,21,25)/b20-10-