N-[[4-[[bis(azanyl)methylideneamino]methyl]cyclohexyl]methyl]-2-(4-chloranylphenoxy)-N-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: N-[[4-[[bis(azanyl)methylideneamino]methyl]cyclohexyl]methyl]-2-(4-chloranylphenoxy)-N-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-(4-chlorophenoxy)-N-[[4-(guanidinomethyl)cyclohexyl]methyl]-N-[(1,1,4,4,7-pentamethyltetralin-6-yl)methyl]pyridine-3-carboxamide CAS Name: 2-(4-chlorophenoxy)-N-[[4-[(diaminomethylideneamino)methyl]cyclohexyl]methyl]-N-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(4-chlorophenoxy)-N-[[4-[(diaminomethylideneamino)methyl]cyclohexyl]methyl]-N-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-(4-chlorophenoxy)-N-[[4-(guanidinomethyl)cyclohexyl]methyl]-N-[(1,1,4,4,7-pentamethyltetralin-6-yl)methyl]nicotinamide Formula: C37H48ClN5O2 MolecularWeight: 630.26232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)CN(CC3CCC(CC3)CN=C(N)N)C(=O)C4=C(N=CC=C4)OC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)CN(CC3CCC(CC3)CN=C(N)N)C(=O)C4=C(N=CC=C4)OC5=CC=C(C=C5)Cl

InChI

InChI=1S/C37H48ClN5O2/c1-24-19-31-32(37(4,5)17-16-36(31,2)3)20-27(24)23-43(22-26-10-8-25(9-11-26)21-42-35(39)40)34(44)30-7-6-18-41-33(30)45-29-14-12-28(38)13-15-29/h6-7,12-15,18-20,25-26H,8-11,16-17,21-23H2,1-5H3,(H4,39,40,42)