N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]-3-carbamimidoyl-benzamide

Systemtic Name: N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]-3-carbamimidoyl-benzamide Openeye Name: N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-oxo-ethyl]-3-carbamimidoyl-benzamide CAS Name: N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide IUPAC Name: N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-oxoethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[2-[[4-(aminomethyl)cyclohexyl]methylamino]-2-keto-ethyl]benzamide Formula: C18H27N5O2 MolecularWeight: 345.43928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)CNC(=O)CNC(=O)C2=CC=CC(=C2)C(=N)N

Isomeric SMILES

C1CC(CCC1CN)CNC(=O)CNC(=O)C2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C18H27N5O2/c19-9-12-4-6-13(7-5-12)10-22-16(24)11-23-18(25)15-3-1-2-14(8-15)17(20)21/h1-3,8,12-13H,4-7,9-11,19H2,(H3,20,21)(H,22,24)(H,23,25)