(2S)-N-methyl-1-(4-methylphenyl)sulfonyl-N-(thiophen-3-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-methyl-1-(4-methylphenyl)sulfonyl-N-(thiophen-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-methyl-1-(p-tolylsulfonyl)-N-(3-thienylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-methyl-1-(4-methylphenyl)sulfonyl-N-(3-thiophenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-methyl-1-(4-methylphenyl)sulfonyl-N-(thiophen-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-methyl-N-(3-thenyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C)CC3=CSC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N(C)CC3=CSC=C3

InChI

InChI=1S/C18H22N2O3S2/c1-14-5-7-16(8-6-14)25(22,23)20-10-3-4-17(20)18(21)19(2)12-15-9-11-24-13-15/h5-9,11,13,17H,3-4,10,12H2,1-2H3/t17-/m0/s1