[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl] (2R)-2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: [2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl] (2R)-2-benzamido-4-methylsulfanyl-butanoate Openeye Name: [2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl] (2R)-2-benzamido-4-methylsulfanyl-butanoate CAS Name: (2R)-2-benzamido-4-(methylthio)butanoic acid [2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl] (2R)-2-benzamido-4-methylsulfanylbutanoate Traditional Name: (2R)-2-benzamido-4-(methylthio)butyric acid [2-keto-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]ethyl] ester Formula: C17H20N4O4S2 MolecularWeight: 408.4951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)COC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(S1)NC(=O)COC(=O)[C@@H](CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H20N4O4S2/c1-11-20-21-17(27-11)19-14(22)10-25-16(24)13(8-9-26-2)18-15(23)12-6-4-3-5-7-12/h3-7,13H,8-10H2,1-2H3,(H,18,23)(H,19,21,22)/t13-/m1/s1