6-[3-butan-2-yl-2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-butan-2-yl-2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)imino-3-sec-butyl-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-butan-2-yl-2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)imino]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-butan-2-yl-2-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)imino]-3-sec-butyl-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CSC1=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CCC(C)N1C(=CSC1=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C26H27N5O3S/c1-5-16(2)30-21(18-11-12-22-20(13-18)27-23(32)14-34-22)15-35-26(30)28-24-17(3)29(4)31(25(24)33)19-9-7-6-8-10-19/h6-13,15-16H,5,14H2,1-4H3,(H,27,32)