N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-4-nitro-benzamide Openeye Name: N-[1-methyl-2-oxo-2-[[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]-4-nitro-benzamide CAS Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-4-nitrobenzamide IUPAC Name: N-[1-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-4-nitrobenzamide Traditional Name: N-[2-keto-1-methyl-2-[[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]-4-nitro-benzamide Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O4S/c1-11-3-5-14(6-4-11)18-22-23-19(29-18)21-16(25)12(2)20-17(26)13-7-9-15(10-8-13)24(27)28/h3-10,12H,1-2H3,(H,20,26)(H,21,23,25)