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

Systemtic Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[2-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-methyl-ethyl]-3-nitro-benzamide Formula: C19H17N5O5S MolecularWeight: 427.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5S/c1-11(20-17(26)13-4-3-5-14(10-13)24(27)28)16(25)21-19-23-22-18(30-19)12-6-8-15(29-2)9-7-12/h3-11H,1-2H3,(H,20,26)(H,21,23,25)