N-(4-butoxyphenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine hydrochloride

Systemtic Name: N-(4-butoxyphenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine hydrochloride Openeye Name: N-(4-butoxyphenyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine hydrochloride CAS Name: N-(4-butoxyphenyl)-5-phenyl-4-thieno[2,3-d]pyrimidinamine hydrochloride IUPAC Name: N-(4-butoxyphenyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine hydrochloride Traditional Name: (4-butoxyphenyl)-(5-phenylthieno[2,3-d]pyrimidin-4-yl)amine hydrochloride Formula: C22H22ClN3OS MolecularWeight: 411.94758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H21N3OS.ClH/c1-2-3-13-26-18-11-9-17(10-12-18)25-21-20-19(16-7-5-4-6-8-16)14-27-22(20)24-15-23-21;/h4-12,14-15H,2-3,13H2,1H3,(H,23,24,25);1H