1,5-dimethyl-4-[[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methyleneamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]methylideneamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]methylideneamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[4-[(1-methylimidazol-2-yl)thio]-3-nitro-benzylidene]amino]-2-phenyl-3-pyrazolin-3-one Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)SC4=NC=CN4C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)SC4=NC=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O3S/c1-15-20(21(29)27(26(15)3)17-7-5-4-6-8-17)24-14-16-9-10-19(18(13-16)28(30)31)32-22-23-11-12-25(22)2/h4-14H,1-3H3