N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(3-methoxyphenyl)carbonyl-pyrrolidin-3-yl]-N-(oxolan-2-ylmethyl)cyclopropanecarboxamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(3-methoxyphenyl)carbonyl-pyrrolidin-3-yl]-N-(oxolan-2-ylmethyl)cyclopropanecarboxamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(3-methoxybenzoyl)pyrrolidin-3-yl]-N-(tetrahydrofuran-2-ylmethyl)cyclopropanecarboxamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(3-methoxyphenyl)-oxomethyl]-3-pyrrolidinyl]-N-(2-oxolanylmethyl)cyclopropanecarboxamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(3-methoxybenzoyl)pyrrolidin-3-yl]-N-(oxolan-2-ylmethyl)cyclopropanecarboxamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-1-m-anisoyl-pyrrolidin-3-yl]-N-(tetrahydrofurfuryl)cyclopropanecarboxamide Formula: C27H38N4O5 MolecularWeight: 498.61442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(CC4CCCO4)C(=O)C5CC5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)N3CCCNCC3)N(CC4CCCO4)C(=O)C5CC5

InChI

InChI=1S/C27H38N4O5/c1-35-22-6-2-5-20(15-22)26(33)31-17-21(16-24(31)27(34)29-12-4-10-28-11-13-29)30(25(32)19-8-9-19)18-23-7-3-14-36-23/h2,5-6,15,19,21,23-24,28H,3-4,7-14,16-18H2,1H3