5,5-dimethyl-2-[6-(1-methylpyrazol-4-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4-oxidanyl-4,6-dihydro-1,3-benzothiazol-7-one

Systemtic Name: 5,5-dimethyl-2-[6-(1-methylpyrazol-4-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4-oxidanyl-4,6-dihydro-1,3-benzothiazol-7-one Openeye Name: 4-hydroxy-5,5-dimethyl-2-[6-(1-methylpyrazol-4-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one CAS Name: 4-hydroxy-5,5-dimethyl-2-[6-(1-methyl-4-pyrazolyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one IUPAC Name: 4-hydroxy-5,5-dimethyl-2-[6-(1-methylpyrazol-4-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one Traditional Name: 4-hydroxy-5,5-dimethyl-2-[6-(1-methylpyrazol-4-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C1O)N=C(S2)N3CCOC4=C3C=C(C=C4)C5=CN(N=C5)C)C

Isomeric SMILES

CC1(CC(=O)C2=C(C1O)N=C(S2)N3CCOC4=C3C=C(C=C4)C5=CN(N=C5)C)C

InChI

InChI=1S/C21H22N4O3S/c1-21(2)9-15(26)18-17(19(21)27)23-20(29-18)25-6-7-28-16-5-4-12(8-14(16)25)13-10-22-24(3)11-13/h4-5,8,10-11,19,27H,6-7,9H2,1-3H3