(phenylmethyl) N-(4-methyl-1H-benzimidazol-2-yl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-(4-methyl-1H-benzimidazol-2-yl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Openeye Name: benzyl N-[(E)-N'-benzyloxycarbonylcarbamimidoyl]-N-(4-methyl-1H-benzimidazol-2-yl)carbamate CAS Name: N-[(E)-amino(phenylmethoxycarbonylimino)methyl]-N-(4-methyl-1H-benzimidazol-2-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-methyl-1H-benzimidazol-2-yl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[(E)-N'-carbobenzoxyamidino]-N-(4-methyl-1H-benzimidazol-2-yl)carbamic acid benzyl ester Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=N2)N(C(=NC(=O)OCC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=N2)N(/C(=N/C(=O)OCC3=CC=CC=C3)/N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23N5O4/c1-17-9-8-14-20-21(17)28-23(27-20)30(25(32)34-16-19-12-6-3-7-13-19)22(26)29-24(31)33-15-18-10-4-2-5-11-18/h2-14H,15-16H2,1H3,(H,27,28)(H2,26,29,31)