6-methylsulfanyl-1-[(Z)-2-phenylethenyl]-N-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-methylsulfanyl-1-[(Z)-2-phenylethenyl]-N-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-benzyl-6-methylsulfanyl-1-[(Z)-styryl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-(methylthio)-1-[(Z)-2-phenylethenyl]-N-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-benzyl-6-methylsulfanyl-1-[(Z)-2-phenylethenyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: benzyl-[6-(methylthio)-1-[(Z)-styryl]pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H19N5S MolecularWeight: 373.47406

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2C=CC3=CC=CC=C3)C(=N1)NCC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(C=NN2/C=C\C3=CC=CC=C3)C(=N1)NCC4=CC=CC=C4

InChI

InChI=1S/C21H19N5S/c1-27-21-24-19(22-14-17-10-6-3-7-11-17)18-15-23-26(20(18)25-21)13-12-16-8-4-2-5-9-16/h2-13,15H,14H2,1H3,(H,22,24,25)/b13-12-