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

Systemtic Name: N-[4-[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3-nitro-benzamide Openeye Name: N-[4-[1-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]-3-nitro-benzamide CAS Name: N-[4-[[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxopropan-2-yl]thio]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]-3-nitrobenzamide Traditional Name: N-[4-[[2-keto-1-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]ethyl]thio]phenyl]-3-nitro-benzamide Formula: C19H17N5O4S2 MolecularWeight: 443.49938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O4S2/c1-11(17(25)21-19-23-22-12(2)30-19)29-16-8-6-14(7-9-16)20-18(26)13-4-3-5-15(10-13)24(27)28/h3-11H,1-2H3,(H,20,26)(H,21,23,25)