6-[(4-iodanyl-3-methyl-phenyl)amino]-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione

Systemtic Name: 6-[(4-iodanyl-3-methyl-phenyl)amino]-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione Openeye Name: 6-(4-iodo-3-methyl-anilino)-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione CAS Name: 6-(4-iodo-3-methylanilino)-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione IUPAC Name: 6-(4-iodo-3-methylanilino)-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione Traditional Name: 6-(4-iodo-3-methyl-anilino)-1,2-dihydropyrazolo[3,4-d]pyrimidine-4-thione Formula: C12H10IN5S MolecularWeight: 383.21077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC(=S)C3=CNNC3=N2)I

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC(=S)C3=CNNC3=N2)I

InChI

InChI=1S/C12H10IN5S/c1-6-4-7(2-3-9(6)13)15-12-16-10-8(5-14-18-10)11(19)17-12/h2-5H,1H3,(H3,14,15,16,17,18,19)