4-(2-chloranylquinolin-3-yl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione

Systemtic Name: 4-(2-chloranylquinolin-3-yl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione Openeye Name: 4-(2-chloro-3-quinolyl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione CAS Name: 4-(2-chloro-3-quinolinyl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione IUPAC Name: 4-(2-chloroquinolin-3-yl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione Traditional Name: 4-(2-chloro-3-quinolyl)-3-methyl-1-phenyl-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-6-thione Formula: C21H16ClN5S MolecularWeight: 405.90324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(NC(=S)N=C2N(N1)C3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

CC1=C2C(NC(=S)N=C2N(N1)C3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C21H16ClN5S/c1-12-17-18(15-11-13-7-5-6-10-16(13)23-19(15)22)24-21(28)25-20(17)27(26-12)14-8-3-2-4-9-14/h2-11,18,26H,1H3,(H,24,28)