N-(3-azanyl-3-azanylidene-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide Traditional Name: 2-[2-(4-amidinophenyl)ethyl]-N-(3-amino-3-imino-propyl)-4-methyl-N-phenethyl-1H-benzimidazole-5-carboxamide Formula: C29H33N7O MolecularWeight: 495.61862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(N2)CCC3=CC=C(C=C3)C(=N)N)C(=O)N(CCC4=CC=CC=C4)CCC(=N)N

Isomeric SMILES

CC1=C(C=CC2=C1N=C(N2)CCC3=CC=C(C=C3)C(=N)N)C(=O)N(CCC4=CC=CC=C4)CCC(=N)N

InChI

InChI=1S/C29H33N7O/c1-19-23(29(37)36(18-16-25(30)31)17-15-20-5-3-2-4-6-20)12-13-24-27(19)35-26(34-24)14-9-21-7-10-22(11-8-21)28(32)33/h2-8,10-13H,9,14-18H2,1H3,(H3,30,31)(H3,32,33)(H,34,35)