N-[2-[[3-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-oxidanylidene-ethyl]-3-carbamimidoyl-benzamide

Systemtic Name: N-[2-[[3-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-oxidanylidene-ethyl]-3-carbamimidoyl-benzamide Openeye Name: N-[2-[[3-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-oxo-ethyl]-3-carbamimidoyl-benzamide CAS Name: N-[2-[[3-(aminomethyl)-4-phenylcyclohexyl]-methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide IUPAC Name: N-[2-[[3-(aminomethyl)-4-phenylcyclohexyl]-methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[2-[[3-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-keto-ethyl]benzamide Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(C(C1)CN)C2=CC=CC=C2)C(=O)CNC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CN(C1CCC(C(C1)CN)C2=CC=CC=C2)C(=O)CNC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C24H31N5O2/c1-29(20-10-11-21(19(13-20)14-25)16-6-3-2-4-7-16)22(30)15-28-24(31)18-9-5-8-17(12-18)23(26)27/h2-9,12,19-21H,10-11,13-15,25H2,1H3,(H3,26,27)(H,28,31)