(2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one

Systemtic Name: (2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Openeye Name: (2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one CAS Name: (2R)-2-[2-(1,3-benzoxazol-2-ylthio)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one IUPAC Name: (2R)-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Traditional Name: (2R)-2-[2-(1,3-benzoxazol-2-ylthio)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(O2)CCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N[C@H](O2)CCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H14N2O3S/c20-16-11-5-1-3-7-13(11)21-15(19-16)9-10-23-17-18-12-6-2-4-8-14(12)22-17/h1-8,15H,9-10H2,(H,19,20)/t15-/m1/s1