3-[(3,5-dimethylphenyl)methyl]-1-prop-2-enyl-4-sulfanylidene-pyrimidin-2-one

Systemtic Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-enyl-4-sulfanylidene-pyrimidin-2-one Openeye Name: 1-allyl-3-[(3,5-dimethylphenyl)methyl]-4-thioxo-pyrimidin-2-one CAS Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-enyl-4-sulfanylidene-2-pyrimidinone IUPAC Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-enyl-4-sulfanylidenepyrimidin-2-one Traditional Name: 1-allyl-3-(3,5-dimethylbenzyl)-4-thioxo-pyrimidin-2-one Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C(=S)C=CN(C2=O)CC=C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C(=S)C=CN(C2=O)CC=C)C

InChI

InChI=1S/C16H18N2OS/c1-4-6-17-7-5-15(20)18(16(17)19)11-14-9-12(2)8-13(3)10-14/h4-5,7-10H,1,6,11H2,2-3H3