N-(2-azanylethyl)-4-[cyclopropylcarbonyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[cyclopropylcarbonyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(2-thienylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[[cyclopropyl(oxo)methyl]-(thiophen-2-ylmethyl)amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(thiophen-2-ylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(2-thenyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C23H27FN4O3S MolecularWeight: 458.548883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NCCN

Isomeric SMILES

C1CC1C(=O)N(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NCCN

InChI

InChI=1S/C23H27FN4O3S/c24-17-7-5-16(6-8-17)23(31)28-13-18(12-20(28)21(29)26-10-9-25)27(22(30)15-3-4-15)14-19-2-1-11-32-19/h1-2,5-8,11,15,18,20H,3-4,9-10,12-14,25H2,(H,26,29)