2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(2-thienylmethyl)propanamide CAS Name: 2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-(2-thenyl)propionamide Formula: C19H17N5OS2 MolecularWeight: 395.50118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

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