N-cyclopropyl-N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-fluorophenyl)carbonyl-pyrrolidin-3-yl]-4-methoxy-benzamide

Systemtic Name: N-cyclopropyl-N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(4-fluorophenyl)carbonyl-pyrrolidin-3-yl]-4-methoxy-benzamide Openeye Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-(4-fluorobenzoyl)pyrrolidin-3-yl]-4-methoxy-benzamide CAS Name: N-cyclopropyl-N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(4-fluorophenyl)-oxomethyl]-3-pyrrolidinyl]-4-methoxybenzamide IUPAC Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-(4-fluorobenzoyl)pyrrolidin-3-yl]-4-methoxybenzamide Traditional Name: N-cyclopropyl-N-[5-(1,4-diazepane-1-carbonyl)-1-(4-fluorobenzoyl)pyrrolidin-3-yl]-4-methoxy-benzamide Formula: C28H33FN4O4 MolecularWeight: 508.584423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)N5CCCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)N5CCCNCC5

InChI

InChI=1S/C28H33FN4O4/c1-37-24-11-5-20(6-12-24)27(35)33(22-9-10-22)23-17-25(28(36)31-15-2-13-30-14-16-31)32(18-23)26(34)19-3-7-21(29)8-4-19/h3-8,11-12,22-23,25,30H,2,9-10,13-18H2,1H3