3-butyl-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-butyl-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C16H15ClN2OS MolecularWeight: 318.8211

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)Cl

InChI

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