dimethyl 5-[2-[(5-cyclopropyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(5-cyclopropyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(5-cyclopropyl-4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(5-cyclopropyl-4-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(5-cyclopropyl-4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(5-cyclopropyl-4-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C3CC3

Isomeric SMILES

CC(C)N1C(=NN=C1SCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C3CC3

InChI

InChI=1S/C20H24N4O5S/c1-11(2)24-17(12-5-6-12)22-23-20(24)30-10-16(25)21-15-8-13(18(26)28-3)7-14(9-15)19(27)29-4/h7-9,11-12H,5-6,10H2,1-4H3,(H,21,25)