3-butyl-7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-butyl-7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-butyl-7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 3-butyl-7-(3-chlorophenyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-butyl-7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-butyl-7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4-one Formula: C16H15ClN2OS MolecularWeight: 318.8211

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C(C1=O)SC=C2C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN1C=NC2=C(C1=O)SC=C2C3=CC(=CC=C3)Cl

InChI

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