(2S)-N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[[4-[2-(dimethylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[[4-[2-(dimethylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[[4-[2-(dimethylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-[2-(dimethylamino)-2-keto-ethoxy]-3-methoxy-benzyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC1=C(C=C(C=C1)CNC(=O)C2CCCN2C(=O)C3=CC=CS3)OC

Isomeric SMILES

CN(C)C(=O)COC1=C(C=C(C=C1)CNC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H27N3O5S/c1-24(2)20(26)14-30-17-9-8-15(12-18(17)29-3)13-23-21(27)16-6-4-10-25(16)22(28)19-7-5-11-31-19/h5,7-9,11-12,16H,4,6,10,13-14H2,1-3H3,(H,23,27)/t16-/m0/s1