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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-(4-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-5-(4-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-5-(4-ethoxyphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-(4-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-(5-p-phenetylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17N3O3S/c1-2-25-15-6-3-13(4-7-15)16-10-28-21-19(16)20(22-11-23-21)24-14-5-8-17-18(9-14)27-12-26-17/h3-11H,2,12H2,1H3,(H,22,23,24)