2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1R)-2-oxidanyl-1-phenyl-2,2-dipyridin-3-yl-ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1R)-2-oxidanyl-1-phenyl-2,2-dipyridin-3-yl-ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1R)-2-hydroxy-1-phenyl-2,2-bis(3-pyridyl)ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(1R)-2-hydroxy-1-phenyl-2,2-bis(3-pyridinyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(1R)-2-hydroxy-1-phenyl-2,2-bis(3-pyridyl)ethyl]acetamide Formula: C27H22N4O2S2 MolecularWeight: 498.61918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C2=CN=CC=C2)(C3=CN=CC=C3)O)NC(=O)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(C2=CN=CC=C2)(C3=CN=CC=C3)O)NC(=O)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H22N4O2S2/c32-24(18-34-26-30-22-12-4-5-13-23(22)35-26)31-25(19-8-2-1-3-9-19)27(33,20-10-6-14-28-16-20)21-11-7-15-29-17-21/h1-17,25,33H,18H2,(H,31,32)/t25-/m1/s1