2-(4-methylphenyl)carbonyl-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-(4-methylphenyl)carbonyl-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-(4-methylbenzoyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-[(4-methylphenyl)-oxomethyl]-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-(4-methylbenzoyl)-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-p-toluoyl-benzamide Formula: C23H16N4O4S MolecularWeight: 444.46254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O4S/c1-14-9-11-15(12-10-14)20(28)18-7-2-3-8-19(18)21(29)24-23-26-25-22(32-23)16-5-4-6-17(13-16)27(30)31/h2-13H,1H3,(H,24,26,29)