N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[oxolan-2-ylmethyl(thiophen-2-ylcarbonyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[oxolan-2-ylmethyl(thiophen-2-ylcarbonyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-methoxybenzoyl)-4-[tetrahydrofuran-2-ylmethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3-methoxyphenyl)-oxomethyl]-4-[2-oxolanylmethyl-[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-methoxybenzoyl)-4-[oxolan-2-ylmethyl(thiophene-2-carbonyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-m-anisoyl-4-[tetrahydrofurfuryl(2-thenoyl)amino]pyrrolidine-2-carboxamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3CCCO3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3CCCO3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H32N4O5S/c1-33-19-6-2-5-17(13-19)24(31)29-15-18(14-21(29)23(30)27-10-9-26)28(16-20-7-3-11-34-20)25(32)22-8-4-12-35-22/h2,4-6,8,12-13,18,20-21H,3,7,9-11,14-16,26H2,1H3,(H,27,30)