2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[1-(2-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]-N-(2-thenyl)acetamide Formula: C19H17N5OS2 MolecularWeight: 395.50118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=N2)C(=NC=N3)SCC(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=N2)C(=NC=N3)SCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C19H17N5OS2/c1-13-5-2-3-7-16(13)24-18-15(10-23-24)19(22-12-21-18)27-11-17(25)20-9-14-6-4-8-26-14/h2-8,10,12H,9,11H2,1H3,(H,20,25)