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

Systemtic Name: N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]-4-(phenylmethyl)benzamide Openeye Name: 4-benzyl-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]-4-(phenylmethyl)benzamide IUPAC Name: 4-benzyl-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-benzyl-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H16N4O3S MolecularWeight: 416.45244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S/c27-20(17-11-9-16(10-12-17)13-15-5-2-1-3-6-15)23-22-25-24-21(30-22)18-7-4-8-19(14-18)26(28)29/h1-12,14H,13H2,(H,23,25,27)