1-(1,3-benzothiazol-5-yl)-6-methyl-5-[(4-methylphenyl)diazenyl]-3-phenyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(1,3-benzothiazol-5-yl)-6-methyl-5-[(4-methylphenyl)diazenyl]-3-phenyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(1,3-benzothiazol-5-yl)-6-methyl-3-phenyl-5-(p-tolylazo)-2-thioxo-pyrimidin-4-one CAS Name: 1-(1,3-benzothiazol-5-yl)-6-methyl-5-(4-methylphenyl)azo-3-phenyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(1,3-benzothiazol-5-yl)-6-methyl-5-[(4-methylphenyl)diazenyl]-3-phenyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(1,3-benzothiazol-5-yl)-6-methyl-3-phenyl-5-(p-tolylazo)-2-thioxo-pyrimidin-4-one Formula: C25H19N5OS2 MolecularWeight: 469.58126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=NC2=C(N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC5=C(C=C4)SC=N5)C

Isomeric SMILES

CC1=CC=C(C=C1)N=NC2=C(N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC5=C(C=C4)SC=N5)C

InChI

InChI=1S/C25H19N5OS2/c1-16-8-10-18(11-9-16)27-28-23-17(2)29(20-12-13-22-21(14-20)26-15-33-22)25(32)30(24(23)31)19-6-4-3-5-7-19/h3-15H,1-2H3