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

Systemtic Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-methyl-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-oxopropan-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-keto-2-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-1-methyl-ethyl]-4-methyl-3-nitro-benzamide Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O5S/c1-11-4-5-14(10-16(11)25(28)29)18(27)21-12(2)17(26)22-20-24-23-19(31-20)13-6-8-15(30-3)9-7-13/h4-10,12H,1-3H3,(H,21,27)(H,22,24,26)