6-phenyl-5-prop-2-enyl-2-propylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-phenyl-5-prop-2-enyl-2-propylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-allyl-6-phenyl-2-propylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-phenyl-5-prop-2-enyl-2-(propylthio)-1H-pyrimidin-4-one IUPAC Name: 6-phenyl-5-prop-2-enyl-2-propylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-allyl-6-phenyl-2-(propylthio)-1H-pyrimidin-4-one Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)CC=C

Isomeric SMILES

CCCSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)CC=C

InChI

InChI=1S/C16H18N2OS/c1-3-8-13-14(12-9-6-5-7-10-12)17-16(18-15(13)19)20-11-4-2/h3,5-7,9-10H,1,4,8,11H2,2H3,(H,17,18,19)