[(2R)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-methyl-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: [(2R)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-methyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [(1R)-2-(dibenzylamino)-1-methyl-2-oxo-ethyl] 4-methylthiadiazole-5-carboxylate CAS Name: 4-methyl-5-thiadiazolecarboxylic acid [(2R)-1-[bis(phenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(dibenzylamino)-1-oxopropan-2-yl] 4-methylthiadiazole-5-carboxylate Traditional Name: 4-methylthiadiazole-5-carboxylic acid [(1R)-2-(dibenzylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)OC(C)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SN=N1)C(=O)O[C@H](C)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-15-19(28-23-22-15)21(26)27-16(2)20(25)24(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12,16H,13-14H2,1-2H3/t16-/m1/s1