1-(4-methylphenyl)sulfonyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[4-(3-nitrophenyl)-2-thiazolyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H20N4O5S2 MolecularWeight: 472.5373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5S2/c1-14-7-9-17(10-8-14)32(29,30)24-11-3-6-19(24)20(26)23-21-22-18(13-31-21)15-4-2-5-16(12-15)25(27)28/h2,4-5,7-10,12-13,19H,3,6,11H2,1H3,(H,22,23,26)