N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]-3,3-dimethyl-N-phenethyl-butanamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-methylphenyl)carbonyl-pyrrolidin-3-yl]-3,3-dimethyl-N-phenethyl-butanamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]-3,3-dimethyl-N-phenethyl-butanamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(4-methylphenyl)-oxomethyl]-3-pyrrolidinyl]-3,3-dimethyl-N-phenethylbutanamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(4-methylbenzoyl)pyrrolidin-3-yl]-3,3-dimethyl-N-phenethylbutanamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-1-p-toluoyl-pyrrolidin-3-yl]-3,3-dimethyl-N-phenethyl-butyramide Formula: C32H44N4O3 MolecularWeight: 532.71676

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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)CC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C32H44N4O3/c1-24-11-13-26(14-12-24)30(38)36-23-27(21-28(36)31(39)34-18-8-16-33-17-20-34)35(29(37)22-32(2,3)4)19-15-25-9-6-5-7-10-25/h5-7,9-14,27-28,33H,8,15-23H2,1-4H3