2-[2-(2-methoxyphenyl)-6-thiophen-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol

Systemtic Name: 2-[2-(2-methoxyphenyl)-6-thiophen-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 2-[2-(2-methoxyphenyl)-6-(2-thienyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 2-[2-(2-methoxyphenyl)-6-thiophen-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-[2-(2-methoxyphenyl)-6-thiophen-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 2-[2-(2-methoxyphenyl)-6-(2-thienyl)-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C21H21N2O2S+ MolecularWeight: 365.46864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2[NH2+]C(C=C(N2)C3=CC=CS3)C4=CC=CC=C4O

Isomeric SMILES

COC1=CC=CC=C1C2[NH2+]C(C=C(N2)C3=CC=CS3)C4=CC=CC=C4O

InChI

InChI=1S/C21H20N2O2S/c1-25-19-10-5-3-8-15(19)21-22-16(14-7-2-4-9-18(14)24)13-17(23-21)20-11-6-12-26-20/h2-13,16,21-24H,1H3/p+1