N-(1,3-benzodioxol-5-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine dihydrochloride

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine dihydrochloride Openeye Name: N-(1,3-benzodioxol-5-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine dihydrochloride CAS Name: N-(1,3-benzodioxol-5-yl)-6-phenyl-4-thieno[2,3-d]pyrimidinamine dihydrochloride IUPAC Name: N-(1,3-benzodioxol-5-yl)-6-phenylthieno[2,3-d]pyrimidin-4-amine dihydrochloride Traditional Name: 1,3-benzodioxol-5-yl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amine dihydrochloride Formula: C19H15Cl2N3O2S MolecularWeight: 420.3123

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C19H13N3O2S.2ClH/c1-2-4-12(5-3-1)17-9-14-18(20-10-21-19(14)25-17)22-13-6-7-15-16(8-13)24-11-23-15;;/h1-10H,11H2,(H,20,21,22);2*1H