4-[[4-(4-cyclohexylphenyl)-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[4-(4-cyclohexylphenyl)-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-(4-cyclohexylphenyl)-3-[(5-nitro-2-furyl)methyleneamino]thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-(4-cyclohexylphenyl)-3-[(5-nitro-2-furanyl)methylideneamino]-2-thiazolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-(4-cyclohexylphenyl)-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(4-cyclohexylphenyl)-3-[(5-nitro-2-furyl)methyleneamino]-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C31H30N6O4S MolecularWeight: 582.6727

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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=CC=C(C=C4)C5CCCCC5)N=CC6=CC=C(O6)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=CS3)C4=CC=C(C=C4)C5CCCCC5)N=CC6=CC=C(O6)[N+](=O)[O-]

InChI

InChI=1S/C31H30N6O4S/c1-21-29(30(38)36(34(21)2)25-11-7-4-8-12-25)33-31-35(32-19-26-17-18-28(41-26)37(39)40)27(20-42-31)24-15-13-23(14-16-24)22-9-5-3-6-10-22/h4,7-8,11-20,22H,3,5-6,9-10H2,1-2H3