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

Systemtic Name: 4-[[4-[(5-azanylidene-1,2,4-dithiazol-3-yl)sulfanyl]-3-nitro-phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-[(5-imino-1,2,4-dithiazol-3-yl)sulfanyl]-3-nitro-phenyl]methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-[(5-imino-1,2,4-dithiazol-3-yl)thio]-3-nitrophenyl]methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-[(5-imino-1,2,4-dithiazol-3-yl)sulfanyl]-3-nitrophenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-[(5-imino-1,2,4-dithiazol-3-yl)thio]-3-nitro-benzylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C20H16N6O3S3 MolecularWeight: 484.57444

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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(=N)SS4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)SC4=NC(=N)SS4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O3S3/c1-12-17(18(27)25(24(12)2)14-6-4-3-5-7-14)22-11-13-8-9-16(15(10-13)26(28)29)30-20-23-19(21)31-32-20/h3-11,21H,1-2H3