[4-[cyclohexylmethyl(phenethyl)amino]-2-(1,4-diazepan-1-ylcarbonyl)pyrrolidin-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[cyclohexylmethyl(phenethyl)amino]-2-(1,4-diazepan-1-ylcarbonyl)pyrrolidin-1-yl]-cyclopropyl-methanone Openeye Name: [4-[cyclohexylmethyl(phenethyl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidin-1-yl]-cyclopropyl-methanone CAS Name: [4-[cyclohexylmethyl(phenethyl)amino]-2-[1,4-diazepan-1-yl(oxo)methyl]-1-pyrrolidinyl]-cyclopropylmethanone IUPAC Name: [4-[cyclohexylmethyl(phenethyl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidin-1-yl]-cyclopropylmethanone Traditional Name: [4-[cyclohexylmethyl(phenethyl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidino]-cyclopropyl-methanone Formula: C29H44N4O2 MolecularWeight: 480.68526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCCNCC5

Isomeric SMILES

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCCNCC5

InChI

InChI=1S/C29H44N4O2/c34-28(25-12-13-25)33-22-26(20-27(33)29(35)31-17-7-15-30-16-19-31)32(21-24-10-5-2-6-11-24)18-14-23-8-3-1-4-9-23/h1,3-4,8-9,24-27,30H,2,5-7,10-22H2