5-methyl-3-(4-methylphenyl)-6-[(E)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-methyl-3-(4-methylphenyl)-6-[(E)-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 5-methyl-6-[(E)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-3-(p-tolyl)-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 5-methyl-3-(4-methylphenyl)-6-[(E)-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-sulfanylidene-7-thiazolo[4,5-d]pyrimidinone IUPAC Name: 5-methyl-3-(4-methylphenyl)-6-[(E)-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-methyl-6-[(E)-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyleneamino]-3-(p-tolyl)-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one Formula: C30H24N6OS2 MolecularWeight: 548.68116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=NN3C(=NC4=C(C3=O)SC(=S)N4C5=CC=C(C=C5)C)C)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=N/N3C(=NC4=C(C3=O)SC(=S)N4C5=CC=C(C=C5)C)C)C6=CC=CC=C6

InChI

InChI=1S/C30H24N6OS2/c1-19-9-13-22(14-10-19)26-23(18-34(33-26)24-7-5-4-6-8-24)17-31-36-21(3)32-28-27(29(36)37)39-30(38)35(28)25-15-11-20(2)12-16-25/h4-18H,1-3H3/b31-17+