4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-ethoxy-benzenecarbonitrile

Systemtic Name: 4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-ethoxy-benzenecarbonitrile Openeye Name: 4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-ethoxy-benzonitrile CAS Name: 4-[[5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinyl]oxy]-3-ethoxybenzonitrile IUPAC Name: 4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-ethoxybenzonitrile Traditional Name: 4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-ethoxy-benzonitrile Formula: C21H14ClN3O2S MolecularWeight: 407.87276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN3O2S/c1-2-26-18-9-13(10-23)3-8-17(18)27-20-19-16(11-28-21(19)25-12-24-20)14-4-6-15(22)7-5-14/h3-9,11-12H,2H2,1H3