N-[1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-2-cyclopropyl-3,7-dimethyl-benzimidazole-5-carboxamide

Systemtic Name: N-[1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-2-cyclopropyl-3,7-dimethyl-benzimidazole-5-carboxamide Openeye Name: N-(1-carbamoyl-4-guanidino-butyl)-2-cyclopropyl-3,7-dimethyl-benzimidazole-5-carboxamide CAS Name: N-[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2-cyclopropyl-3,7-dimethyl-5-benzimidazolecarboxamide IUPAC Name: N-[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2-cyclopropyl-3,7-dimethylbenzimidazole-5-carboxamide Traditional Name: N-(1-carbamoyl-4-guanidino-butyl)-2-cyclopropyl-3,7-dimethyl-benzimidazole-5-carboxamide Formula: C19H27N7O2 MolecularWeight: 385.46338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=O)NC(CCCN=C(N)N)C(=O)N)N(C(=N2)C3CC3)C

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=O)NC(CCCN=C(N)N)C(=O)N)N(C(=N2)C3CC3)C

InChI

InChI=1S/C19H27N7O2/c1-10-8-12(9-14-15(10)25-17(26(14)2)11-5-6-11)18(28)24-13(16(20)27)4-3-7-23-19(21)22/h8-9,11,13H,3-7H2,1-2H3,(H2,20,27)(H,24,28)(H4,21,22,23)