6-[3-(cycloheptylideneamino)-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-(cycloheptylideneamino)-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-[3-(cycloheptylideneamino)-2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(cycloheptylideneamino)-2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)imino]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(cycloheptylideneamino)-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-[3-(cycloheptylideneamino)-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)imino]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C29H30N6O3S MolecularWeight: 542.6519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC5=C(C=C4)OCC(=O)N5)N=C6CCCCCC6

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC5=C(C=C4)OCC(=O)N5)N=C6CCCCCC6

InChI

InChI=1S/C29H30N6O3S/c1-19-27(28(37)35(33(19)2)22-12-8-5-9-13-22)31-29-34(32-21-10-6-3-4-7-11-21)24(18-39-29)20-14-15-25-23(16-20)30-26(36)17-38-25/h5,8-9,12-16,18H,3-4,6-7,10-11,17H2,1-2H3,(H,30,36)