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

Systemtic Name: N-(2-azanylethyl)-1-(4-fluorophenyl)carbonyl-4-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[2-methylpropanoyl(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-fluorophenyl)-oxomethyl]-4-[(2-methyl-1-oxopropyl)-(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[isobutyryl(2-thenyl)amino]pyrrolidine-2-carboxamide Formula: C23H29FN4O3S MolecularWeight: 460.564763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CC1=CC=CS1)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN

Isomeric SMILES

CC(C)C(=O)N(CC1=CC=CS1)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN

InChI

InChI=1S/C23H29FN4O3S/c1-15(2)22(30)27(14-19-4-3-11-32-19)18-12-20(21(29)26-10-9-25)28(13-18)23(31)16-5-7-17(24)8-6-16/h3-8,11,15,18,20H,9-10,12-14,25H2,1-2H3,(H,26,29)