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

Systemtic Name: N-(2-azanylethyl)-1-(4-fluorophenyl)carbonyl-4-[oxolan-2-ylmethyl(thiophen-2-ylcarbonyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[tetrahydrofuran-2-ylmethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-fluorophenyl)-oxomethyl]-4-[2-oxolanylmethyl-[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[oxolan-2-ylmethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[tetrahydrofurfuryl(2-thenoyl)amino]pyrrolidine-2-carboxamide Formula: C24H29FN4O4S MolecularWeight: 488.574863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN)C(=O)C4=CC=CS4

Isomeric SMILES

C1CC(OC1)CN(C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H29FN4O4S/c25-17-7-5-16(6-8-17)23(31)29-14-18(13-20(29)22(30)27-10-9-26)28(15-19-3-1-11-33-19)24(32)21-4-2-12-34-21/h2,4-8,12,18-20H,1,3,9-11,13-15,26H2,(H,27,30)