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

Systemtic Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]-4-methyl-3-nitro-benzamide CAS Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-propyl]-4-methyl-3-nitro-benzamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C22H23N5O5S/c1-12(2)18(23-19(28)15-6-5-13(3)17(11-15)27(30)31)20(29)24-22-26-25-21(33-22)14-7-9-16(32-4)10-8-14/h5-12,18H,1-4H3,(H,23,28)(H,24,26,29)