cyclopropyl-[2-(1,4-diazepan-1-ylcarbonyl)-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]pyrrolidin-1-yl]methanone

Systemtic Name: cyclopropyl-[2-(1,4-diazepan-1-ylcarbonyl)-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]pyrrolidin-1-yl]methanone Openeye Name: [4-[benzyl(tetrahydrofuran-2-ylmethyl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidin-1-yl]-cyclopropyl-methanone CAS Name: cyclopropyl-[2-[1,4-diazepan-1-yl(oxo)methyl]-4-[2-oxolanylmethyl-(phenylmethyl)amino]-1-pyrrolidinyl]methanone IUPAC Name: [4-[benzyl(oxolan-2-ylmethyl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidin-1-yl]-cyclopropylmethanone Traditional Name: [4-[benzyl(tetrahydrofurfuryl)amino]-2-(1,4-diazepane-1-carbonyl)pyrrolidino]-cyclopropyl-methanone Formula: C26H38N4O3 MolecularWeight: 454.60492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCCNCC5

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)N5CCCNCC5

InChI

InChI=1S/C26H38N4O3/c31-25(21-9-10-21)30-18-22(16-24(30)26(32)28-13-5-11-27-12-14-28)29(19-23-8-4-15-33-23)17-20-6-2-1-3-7-20/h1-3,6-7,21-24,27H,4-5,8-19H2