(phenylmethyl) N-[(2R)-1-(1,3-benzothiazol-2-yl)-1-oxidanyl-4-phenyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2R)-1-(1,3-benzothiazol-2-yl)-1-oxidanyl-4-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1R)-1-[1,3-benzothiazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]carbamate CAS Name: N-[(2R)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-4-phenylbutan-2-yl]carbamate Traditional Name: N-[(1R)-1-[1,3-benzothiazol-2-yl(hydroxy)methyl]-3-phenyl-propyl]carbamic acid benzyl ester Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(C2=NC3=CC=CC=C3S2)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC[C@H](C(C2=NC3=CC=CC=C3S2)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O3S/c28-23(24-26-20-13-7-8-14-22(20)31-24)21(16-15-18-9-3-1-4-10-18)27-25(29)30-17-19-11-5-2-6-12-19/h1-14,21,23,28H,15-17H2,(H,27,29)/t21-,23?/m1/s1