6-chloranyl-7-(thian-4-ylamino)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-(thian-4-ylamino)-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-(tetrahydrothiopyran-4-ylamino)-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-(4-thianylamino)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-(thian-4-ylamino)-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-(tetrahydrothiopyran-4-ylamino)-4H-1,4-benzoxazin-3-one Formula: C13H15ClN2O2S MolecularWeight: 298.7884

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

C1CSCCC1NC2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C13H15ClN2O2S/c14-9-5-11-12(18-7-13(17)16-11)6-10(9)15-8-1-3-19-4-2-8/h5-6,8,15H,1-4,7H2,(H,16,17)