2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(cyclohexylmethyl)carbamimidoyl]ethanamide

Systemtic Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(cyclohexylmethyl)carbamimidoyl]ethanamide Openeye Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(cyclohexylmethyl)carbamimidoyl]acetamide CAS Name: 2-[2-(1-adamantyl)-5-phenyl-1-pyrrolyl]-N-[amino(cyclohexylmethylimino)methyl]acetamide IUPAC Name: 2-[2-(1-adamantyl)-5-phenylpyrrol-1-yl]-N-[N'-(cyclohexylmethyl)carbamimidoyl]acetamide Traditional Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(cyclohexylmethyl)amidino]acetamide Formula: C30H40N4O MolecularWeight: 472.6648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN=C(N)NC(=O)CN2C(=CC=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)CN=C(N)NC(=O)CN2C(=CC=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C30H40N4O/c31-29(32-19-21-7-3-1-4-8-21)33-28(35)20-34-26(25-9-5-2-6-10-25)11-12-27(34)30-16-22-13-23(17-30)15-24(14-22)18-30/h2,5-6,9-12,21-24H,1,3-4,7-8,13-20H2,(H3,31,32,33,35)