4-[(E)-2-(3-methoxyphenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione

Systemtic Name: 4-[(E)-2-(3-methoxyphenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Openeye Name: 4-[(E)-2-(3-methoxyphenyl)vinyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione CAS Name: 4-[(E)-2-(3-methoxyphenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione IUPAC Name: 4-[(E)-2-(3-methoxyphenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Traditional Name: 4-[(E)-2-(3-methoxyphenyl)vinyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Formula: C15H19N2OS+ MolecularWeight: 275.38916

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=[NH+]C(=S)N1)C=CC2=CC(=CC=C2)OC)C

Isomeric SMILES

CC1(CC(=[NH+]C(=S)N1)/C=C/C2=CC(=CC=C2)OC)C

InChI

InChI=1S/C15H18N2OS/c1-15(2)10-12(16-14(19)17-15)8-7-11-5-4-6-13(9-11)18-3/h4-9H,10H2,1-3H3,(H,17,19)/p+1/b8-7+