N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]-2-methyl-N-phenethyl-propanamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]-2-methyl-N-phenethyl-propanamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]-2-methyl-N-phenethyl-propanamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(4-methylphenyl)-oxomethyl]-3-pyrrolidinyl]-2-methyl-N-phenethylpropanamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]-2-methyl-N-phenethylpropanamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-1-p-toluoyl-pyrrolidin-3-yl]-2-methyl-N-phenethyl-propionamide Formula: C30H40N4O3 MolecularWeight: 504.6636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(CCC4=CC=CC=C4)C(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(CCC4=CC=CC=C4)C(=O)C(C)C

InChI

InChI=1S/C30H40N4O3/c1-22(2)28(35)33(18-14-24-8-5-4-6-9-24)26-20-27(30(37)32-17-7-15-31-16-19-32)34(21-26)29(36)25-12-10-23(3)11-13-25/h4-6,8-13,22,26-27,31H,7,14-21H2,1-3H3