2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(1-chloroethyl)-5-(4-ethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H15ClN2OS MolecularWeight: 318.8211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)C(C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)C(C)Cl

InChI

InChI=1S/C16H15ClN2OS/c1-3-10-4-6-11(7-5-10)12-8-21-16-13(12)15(20)18-14(19-16)9(2)17/h4-9H,3H2,1-2H3,(H,18,19,20)