3-(4-carbamimidoylphenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-oxidanylidene-2-(piperidin-4-ylmethylamino)ethyl]propanamide

Systemtic Name: 3-(4-carbamimidoylphenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-oxidanylidene-2-(piperidin-4-ylmethylamino)ethyl]propanamide Openeye Name: 3-(4-carbamimidoylphenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-oxo-2-(4-piperidylmethylamino)ethyl]propanamide CAS Name: 3-(4-carbamimidoylphenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-oxo-2-(4-piperidinylmethylamino)ethyl]propanamide IUPAC Name: 3-(4-carbamimidoylphenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-oxo-2-(piperidin-4-ylmethylamino)ethyl]propanamide Traditional Name: 3-(4-amidinophenyl)-2-cyclohexyl-N-[1-cyclohexyl-2-keto-2-(4-piperidylmethylamino)ethyl]propionamide Formula: C30H47N5O2 MolecularWeight: 509.72648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC2=CC=C(C=C2)C(=N)N)C(=O)NC(C3CCCCC3)C(=O)NCC4CCNCC4

Isomeric SMILES

C1CCC(CC1)C(CC2=CC=C(C=C2)C(=N)N)C(=O)NC(C3CCCCC3)C(=O)NCC4CCNCC4

InChI

InChI=1S/C30H47N5O2/c31-28(32)25-13-11-21(12-14-25)19-26(23-7-3-1-4-8-23)29(36)35-27(24-9-5-2-6-10-24)30(37)34-20-22-15-17-33-18-16-22/h11-14,22-24,26-27,33H,1-10,15-20H2,(H3,31,32)(H,34,37)(H,35,36)