N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(4-nitrophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(4-nitrophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]-1-(4-nitrophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(4-nitrophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-1-(4-nitrophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]-1-nosyl-pyrrolidine-2-carboxamide Formula: C20H19N5O5S2 MolecularWeight: 473.52536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O5S2/c1-13-4-2-5-14(12-13)19-22-23-20(31-19)21-18(26)17-6-3-11-24(17)32(29,30)16-9-7-15(8-10-16)25(27)28/h2,4-5,7-10,12,17H,3,6,11H2,1H3,(H,21,23,26)