2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-[2-(phenylthio)phenyl]propionamide Formula: C21H19N5OS2 MolecularWeight: 421.53846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)SC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)SC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C21H19N5OS2/c1-14(28-21-16-12-24-26(2)19(16)22-13-23-21)20(27)25-17-10-6-7-11-18(17)29-15-8-4-3-5-9-15/h3-14H,1-2H3,(H,25,27)