1,3-benzothiazol-2-ylmethyl (2R)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (2R)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (2R)-3-phenyl-2-(tetrazol-1-yl)propanoate CAS Name: (2R)-3-phenyl-2-(1-tetrazolyl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (2R)-3-phenyl-2-(tetrazol-1-yl)propanoate Traditional Name: (2R)-3-phenyl-2-(tetrazol-1-yl)propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=NC3=CC=CC=C3S2)N4C=NN=N4

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)OCC2=NC3=CC=CC=C3S2)N4C=NN=N4

InChI

InChI=1S/C18H15N5O2S/c24-18(25-11-17-20-14-8-4-5-9-16(14)26-17)15(23-12-19-21-22-23)10-13-6-2-1-3-7-13/h1-9,12,15H,10-11H2/t15-/m1/s1