4-cyclohexylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-cyclohexylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-cyclohexylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(cyclohexylthio)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-cyclohexylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(cyclohexylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H18N4S/c1-3-7-13(8-4-1)21-16-15(11-20-21)17(19-12-18-16)22-14-9-5-2-6-10-14/h1,3-4,7-8,11-12,14H,2,5-6,9-10H2