[(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl] N'-phenylazanyl-N-phenylimino-carbamimidothioate

Systemtic Name: [(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-oxidanylidene-naphthalen-2-yl] N'-phenylazanyl-N-phenylimino-carbamimidothioate Openeye Name: 3-anilino-2-[(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-oxo-2-naphthyl]-1-phenylimino-isothiourea CAS Name: N'-anilino-N-phenyliminocarbamimidothioic acid [(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-oxo-2-naphthalenyl] ester IUPAC Name: [(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-oxonaphthalen-2-yl] N'-anilino-N-phenyliminocarbamimidothioate Traditional Name: 3-anilino-2-[(4E)-4-(2,5-dimethylphenyl)sulfonylimino-1-keto-2-naphthyl]-1-phenylimino-isothiourea Formula: C31H25N5O3S2 MolecularWeight: 579.6919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N=C2C=C(C(=O)C3=CC=CC=C32)SC(=NNC4=CC=CC=C4)N=NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)/N=C/2\C=C(C(=O)C3=CC=CC=C32)S/C(=N/NC4=CC=CC=C4)/N=NC5=CC=CC=C5

InChI

InChI=1S/C31H25N5O3S2/c1-21-17-18-22(2)29(19-21)41(38,39)36-27-20-28(30(37)26-16-10-9-15-25(26)27)40-31(34-32-23-11-5-3-6-12-23)35-33-24-13-7-4-8-14-24/h3-20,32H,1-2H3/b34-31+,35-33?,36-27+