3-[(4-tert-butylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[(4-tert-butylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[(4-tert-butylphenyl)methyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[(4-tert-butylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-tert-butylbenzyl)thieno[3,2-d]pyrimidin-4-one Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)SC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)SC=C3

InChI

InChI=1S/C17H18N2OS/c1-17(2,3)13-6-4-12(5-7-13)10-19-11-18-14-8-9-21-15(14)16(19)20/h4-9,11H,10H2,1-3H3