6-[3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-phenylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-phenylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-phenylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C28H21ClN6O2S MolecularWeight: 541.02334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2C(=CSC2=NC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)Cl)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C(=C1C=NN2C(=CSC2=NC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C28H21ClN6O2S/c1-18-22(27(29)34(33-18)21-10-6-3-7-11-21)15-30-35-24(17-38-28(35)31-20-8-4-2-5-9-20)19-12-13-25-23(14-19)32-26(36)16-37-25/h2-15,17H,16H2,1H3,(H,32,36)