3-heptyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-heptyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-heptyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-heptyl-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-heptyl-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-heptyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N2OS MolecularWeight: 326.45578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2OS/c1-2-3-4-5-9-12-21-14-20-18-16(19(21)22)13-17(23-18)15-10-7-6-8-11-15/h6-8,10-11,13-14H,2-5,9,12H2,1H3