N-[4-[(E)-N-[bis(azanyl)methylideneamino]-C-methyl-carbonimidoyl]phenyl]-1H-benzimidazole-2-carboxamide

Systemtic Name: N-[4-[(E)-N-[bis(azanyl)methylideneamino]-C-methyl-carbonimidoyl]phenyl]-1H-benzimidazole-2-carboxamide Openeye Name: N-[4-[(E)-N-guanidino-C-methyl-carbonimidoyl]phenyl]-1H-benzimidazole-2-carboxamide CAS Name: N-[4-[(1E)-1-(diaminomethylidenehydrazinylidene)ethyl]phenyl]-1H-benzimidazole-2-carboxamide IUPAC Name: N-[4-[(E)-N-(diaminomethylideneamino)-C-methylcarbonimidoyl]phenyl]-1H-benzimidazole-2-carboxamide Traditional Name: N-[4-[(E)-N-guanidino-C-methyl-carbonimidoyl]phenyl]-1H-benzimidazole-2-carboxamide Formula: C17H17N7O MolecularWeight: 335.36318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N)N)C1=CC=C(C=C1)NC(=O)C2=NC3=CC=CC=C3N2

Isomeric SMILES

C/C(=N\N=C(N)N)/C1=CC=C(C=C1)NC(=O)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H17N7O/c1-10(23-24-17(18)19)11-6-8-12(9-7-11)20-16(25)15-21-13-4-2-3-5-14(13)22-15/h2-9H,1H3,(H,20,25)(H,21,22)(H4,18,19,24)/b23-10+