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

Systemtic Name: N-[2-[[4-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-oxidanylidene-ethyl]-3-carbamimidoyl-benzamide Openeye Name: N-[2-[[4-(aminomethyl)-4-phenyl-cyclohexyl]-methyl-amino]-2-oxo-ethyl]-3-carbamimidoyl-benzamide CAS Name: N-[2-[[4-(aminomethyl)-4-phenylcyclohexyl]-methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide IUPAC Name: N-[2-[[4-(aminomethyl)-4-phenylcyclohexyl]-methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[2-[[4-(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(CC1)(CN)C2=CC=CC=C2)C(=O)CNC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

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

InChI

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