methyl 4-[(2R)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoate

Systemtic Name: methyl 4-[(2R)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoate Openeye Name: methyl 4-[(2R)-5-(p-tolyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoate CAS Name: 4-[(2R)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2R)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoate Traditional Name: 4-[(2R)-5-(p-tolyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]benzoic acid methyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(S2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN[C@H](S2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H16N2O2S/c1-11-3-5-12(6-4-11)15-18-19-16(22-15)13-7-9-14(10-8-13)17(20)21-2/h3-10,16,19H,1-2H3/t16-/m1/s1