3-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(E)-[1-methyl-2-[5-(methylamino)-1,2,4-thiadiazol-3-yl]ethylidene]amino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(E)-[1-methyl-2-[5-(methylamino)-1,2,4-thiadiazol-3-yl]ethylidene]amino]phthalazine-1-carboxamide Formula: C16H17N7O2S MolecularWeight: 371.41688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)CC3=NSC(=N3)NC

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/CC3=NSC(=N3)NC

InChI

InChI=1S/C16H17N7O2S/c1-9(8-12-18-16(17-2)26-22-12)19-20-14(24)13-10-6-4-5-7-11(10)15(25)23(3)21-13/h4-7H,8H2,1-3H3,(H,20,24)(H,17,18,22)/b19-9+