6-[2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(N2C3=CC=CC=C3)SCC(=O)C4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

C1CCC2=C(C1)N=C(N2C3=CC=CC=C3)SCC(=O)C4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C23H21N3O3S/c27-20(15-10-11-21-18(12-15)24-22(28)13-29-21)14-30-23-25-17-8-4-5-9-19(17)26(23)16-6-2-1-3-7-16/h1-3,6-7,10-12H,4-5,8-9,13-14H2,(H,24,28)