1,3-benzothiazol-2-ylmethyl (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid 1,3-benzothiazol-2-ylmethyl ester Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC1=NC2=CC=CC=C2S1)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)OCC1=NC2=CC=CC=C2S1)NC(=O)N

InChI

InChI=1S/C14H17N3O3S2/c1-21-7-6-10(17-14(15)19)13(18)20-8-12-16-9-4-2-3-5-11(9)22-12/h2-5,10H,6-8H2,1H3,(H3,15,17,19)/t10-/m1/s1