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

Systemtic Name: (2R)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Openeye Name: (2R)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one CAS Name: (2R)-2-[2-(1H-benzimidazol-2-ylthio)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one IUPAC Name: (2R)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Traditional Name: (2R)-2-[2-(1H-benzimidazol-2-ylthio)ethyl]-2,3-dihydro-1,3-benzoxazin-4-one Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(O2)CCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N[C@H](O2)CCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H15N3O2S/c21-16-11-5-1-4-8-14(11)22-15(20-16)9-10-23-17-18-12-6-2-3-7-13(12)19-17/h1-8,15H,9-10H2,(H,18,19)(H,20,21)/t15-/m1/s1