methyl 3-[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H25N3O4S/c1-14-6-7-16(21(28)29-5)12-18(14)24-19(27)13-31-22-26-25-20(30-22)15-8-10-17(11-9-15)23(2,3)4/h6-12H,13H2,1-5H3,(H,24,27)