1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-2-furyl]methyleneamino]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-2-furanyl]methylideneamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-2-furyl]methyleneamino]-2-phenyl-3-pyrazolin-3-one Formula: C23H17N5O4S2 MolecularWeight: 491.54218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)SC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)SC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H17N5O4S2/c1-14-21(22(29)27(26(14)2)15-6-4-3-5-7-15)24-13-17-9-11-20(32-17)34-23-25-18-10-8-16(28(30)31)12-19(18)33-23/h3-13H,1-2H3