N-(4,6-dimethylpyrimidin-2-yl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(4,5-diphenyl-1,3-dithiol-2-ylidene)amino]benzenesulfonamide Formula: C27H22N4O2S3 MolecularWeight: 530.68418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=C3SC(=C(S3)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=C3SC(=C(S3)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C27H22N4O2S3/c1-18-17-19(2)29-26(28-18)31-36(32,33)23-15-13-22(14-16-23)30-27-34-24(20-9-5-3-6-10-20)25(35-27)21-11-7-4-8-12-21/h3-17H,1-2H3,(H,28,29,31)