6-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C19H17N3O4S/c1-10(27-19-21-13-5-4-12(25-2)8-14(13)22-19)18(24)11-3-6-16-15(7-11)20-17(23)9-26-16/h3-8,10H,9H2,1-2H3,(H,20,23)(H,21,22)