N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(4-heptyl-2-methylphenoxy)ethyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(4-heptyl-2-methylphenoxy)ethyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: 2-(4-heptyl-2-methyl-phenoxy)ethyl-thieno[2,3-d]pyrimidin-4-yl-amine Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C3C=CSC3=NC=N2)C

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C3C=CSC3=NC=N2)C

InChI

InChI=1S/C22H29N3OS/c1-3-4-5-6-7-8-18-9-10-20(17(2)15-18)26-13-12-23-21-19-11-14-27-22(19)25-16-24-21/h9-11,14-16H,3-8,12-13H2,1-2H3,(H,23,24,25)