N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methyl-3-nitro-phenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methyl-3-nitro-phenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methyl-3-nitro-benzoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[(4-methyl-3-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methyl-3-nitrobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-methyl-3-nitro-benzoyl)pyrrolidine-2-carboxamide Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H24N6O4S/c1-14-6-7-16(13-19(14)29(32)33)22(31)28-12-4-5-18(28)20(30)24-23-26-25-21(34-23)15-8-10-17(11-9-15)27(2)3/h6-11,13,18H,4-5,12H2,1-3H3,(H,24,26,30)