2-methyl-3-nitro-N-[5-(3-oxidanylidene-3-phenyl-propyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-methyl-3-nitro-N-[5-(3-oxidanylidene-3-phenyl-propyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-methyl-3-nitro-N-[5-(3-oxo-3-phenyl-propyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-methyl-3-nitro-N-[5-(3-oxo-3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-methyl-3-nitro-N-[5-(3-oxo-3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-(3-keto-3-phenyl-propyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitro-benzamide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)CCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)CCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N4O4S/c1-12-14(8-5-9-15(12)23(26)27)18(25)20-19-22-21-17(28-19)11-10-16(24)13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H,20,22,25)