ethyl N-[2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazol-5-yl]carbonyl-phenyl-amino]ethanoyl]-N-methyl-carbamate

Systemtic Name: ethyl N-[2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazol-5-yl]carbonyl-phenyl-amino]ethanoyl]-N-methyl-carbamate Openeye Name: ethyl N-[2-(N-[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-benzimidazole-5-carbonyl]anilino)acetyl]-N-methyl-carbamate CAS Name: N-[2-(N-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-5-benzimidazolyl]-oxomethyl]anilino)-1-oxoethyl]-N-methylcarbamic acid ethyl ester IUPAC Name: ethyl N-[2-(N-[2-[(4-carbamimidoylphenyl)methyl]-1-methylbenzimidazole-5-carbonyl]anilino)acetyl]-N-methylcarbamate Traditional Name: N-[2-(N-[2-(4-amidinobenzyl)-1-methyl-benzimidazole-5-carbonyl]anilino)acetyl]-N-methyl-carbamic acid ethyl ester Formula: C29H30N6O4 MolecularWeight: 526.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C)C(=O)CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C(=N)N)C

Isomeric SMILES

CCOC(=O)N(C)C(=O)CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C(=N)N)C

InChI

InChI=1S/C29H30N6O4/c1-4-39-29(38)34(3)26(36)18-35(22-8-6-5-7-9-22)28(37)21-14-15-24-23(17-21)32-25(33(24)2)16-19-10-12-20(13-11-19)27(30)31/h5-15,17H,4,16,18H2,1-3H3,(H3,30,31)