N4-(3-chlorophenyl)-N3-methyl-N3-thiophen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine

Systemtic Name: N4-(3-chlorophenyl)-N3-methyl-N3-thiophen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N4-(3-chlorophenyl)-N3-methyl-N3-(2-thienyl)-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N4-(3-chlorophenyl)-N3-methyl-N3-thiophen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 4-N-(3-chlorophenyl)-3-N-methyl-3-N-thiophen-2-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [4-(3-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-methyl-(2-thienyl)amine Formula: C16H13ClN6S MolecularWeight: 356.83262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CS1)C2=NNC3=C2C(=NC=N3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CN(C1=CC=CS1)C2=NNC3=C2C(=NC=N3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C16H13ClN6S/c1-23(12-6-3-7-24-12)16-13-14(18-9-19-15(13)21-22-16)20-11-5-2-4-10(17)8-11/h2-9H,1H3,(H2,18,19,20,21,22)