3-methyl-N-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-1-(4-mesylphenyl)ethylideneamino]-3-methyl-phthalazine-1-carboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

C/C(=N/NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H18N4O4S/c1-12(13-8-10-14(11-9-13)28(3,26)27)20-21-18(24)17-15-6-4-5-7-16(15)19(25)23(2)22-17/h4-11H,1-3H3,(H,21,24)/b20-12-