1,5-dimethyl-4-[[3-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-ylidene]amino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[3-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-ylidene]amino]-2-phenyl-pyrazol-3-one Openeye Name: 4-[[3-isopentyl-4-(3-nitrophenyl)thiazol-2-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[3-(3-methylbutyl)-4-(3-nitrophenyl)-2-thiazolylidene]amino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[3-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-ylidene]amino]-2-phenylpyrazol-3-one Traditional Name: 4-[[3-isoamyl-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C25H27N5O3S MolecularWeight: 477.57858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5O3S/c1-17(2)13-14-28-22(19-9-8-12-21(15-19)30(32)33)16-34-25(28)26-23-18(3)27(4)29(24(23)31)20-10-6-5-7-11-20/h5-12,15-17H,13-14H2,1-4H3