[1-[5-[(4-cyclohexylphenyl)carbonyl-pentan-3-yl-amino]pyridin-2-yl]pyrrolidin-3-yl] N-methylcarbamate

Systemtic Name: [1-[5-[(4-cyclohexylphenyl)carbonyl-pentan-3-yl-amino]pyridin-2-yl]pyrrolidin-3-yl] N-methylcarbamate Openeye Name: [1-[5-[(4-cyclohexylbenzoyl)-(1-ethylpropyl)amino]-2-pyridyl]pyrrolidin-3-yl] N-methylcarbamate CAS Name: N-methylcarbamic acid [1-[5-[[(4-cyclohexylphenyl)-oxomethyl]-pentan-3-ylamino]-2-pyridinyl]-3-pyrrolidinyl] ester IUPAC Name: [1-[5-[(4-cyclohexylbenzoyl)-pentan-3-ylamino]pyridin-2-yl]pyrrolidin-3-yl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [1-[5-[(4-cyclohexylbenzoyl)-(1-ethylpropyl)amino]-2-pyridyl]pyrrolidin-3-yl] ester Formula: C29H40N4O3 MolecularWeight: 492.6529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(C1=CN=C(C=C1)N2CCC(C2)OC(=O)NC)C(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCC(CC)N(C1=CN=C(C=C1)N2CCC(C2)OC(=O)NC)C(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C29H40N4O3/c1-4-24(5-2)33(28(34)23-13-11-22(12-14-23)21-9-7-6-8-10-21)25-15-16-27(31-19-25)32-18-17-26(20-32)36-29(35)30-3/h11-16,19,21,24,26H,4-10,17-18,20H2,1-3H3,(H,30,35)