2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-(1-phenylethyl)ethanamide Openeye Name: 2-[5-carbamimidoyl-2-[[4-[(1-ethanimidoyl-4-piperidyl)oxy]phenoxy]methyl]benzimidazol-1-yl]-N-(1-phenylethyl)acetamide CAS Name: 2-[5-carbamimidoyl-2-[[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]phenoxy]methyl]-1-benzimidazolyl]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-(1-phenylethyl)acetamide Traditional Name: 2-[2-[[4-[(1-acetimidoyl-4-piperidyl)oxy]phenoxy]methyl]-5-amidino-benzimidazol-1-yl]-N-(1-phenylethyl)acetamide Formula: C32H37N7O3 MolecularWeight: 567.68128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)C(=N)N)N=C2COC4=CC=C(C=C4)OC5CCN(CC5)C(=N)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)C(=N)N)N=C2COC4=CC=C(C=C4)OC5CCN(CC5)C(=N)C

InChI

InChI=1S/C32H37N7O3/c1-21(23-6-4-3-5-7-23)36-31(40)19-39-29-13-8-24(32(34)35)18-28(29)37-30(39)20-41-25-9-11-26(12-10-25)42-27-14-16-38(17-15-27)22(2)33/h3-13,18,21,27,33H,14-17,19-20H2,1-2H3,(H3,34,35)(H,36,40)