N-[[4-[cyano-(N'-methylcarbamimidoyl)amino]-1-phenyl-cyclohexyl]methyl]-2-phenylmethoxy-benzamide

Systemtic Name: N-[[4-[cyano-(N'-methylcarbamimidoyl)amino]-1-phenyl-cyclohexyl]methyl]-2-phenylmethoxy-benzamide Openeye Name: 2-benzyloxy-N-[[4-[cyano-(N'-methylcarbamimidoyl)amino]-1-phenyl-cyclohexyl]methyl]benzamide CAS Name: N-[[4-[[amino(methylimino)methyl]-cyanoamino]-1-phenylcyclohexyl]methyl]-2-phenylmethoxybenzamide IUPAC Name: N-[[4-[cyano-(N'-methylcarbamimidoyl)amino]-1-phenylcyclohexyl]methyl]-2-phenylmethoxybenzamide Traditional Name: 2-benzoxy-N-[[4-[cyano-(N'-methylamidino)amino]-1-phenyl-cyclohexyl]methyl]benzamide Formula: C30H33N5O2 MolecularWeight: 495.61532

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(C#N)C1CCC(CC1)(CNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN=C(N)N(C#N)C1CCC(CC1)(CNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H33N5O2/c1-33-29(32)35(22-31)25-16-18-30(19-17-25,24-12-6-3-7-13-24)21-34-28(36)26-14-8-9-15-27(26)37-20-23-10-4-2-5-11-23/h2-15,25H,16-21H2,1H3,(H2,32,33)(H,34,36)