3-[2-(1H-benzimidazol-2-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-(1H-benzimidazol-2-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-(1H-benzimidazol-2-ylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-(1H-benzimidazol-2-ylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C18H14N6O3 MolecularWeight: 362.34216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=NC4=CC=CC=C4N3)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=NC4=CC=CC=C4N3)C(=O)N

InChI

InChI=1S/C18H14N6O3/c19-16(26)15-10-5-1-2-6-11(10)17(27)24(23-15)9-14(25)22-18-20-12-7-3-4-8-13(12)21-18/h1-8H,9H2,(H2,19,26)(H2,20,21,22,25)