2-hydroxyethyl-[[4-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[[4-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-hydroxyethyl-[[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-(2-thienylmethyl)ammonium CAS Name: 2-hydroxyethyl-[[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: 2-hydroxyethyl-[[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-hydroxyethyl-[4-(4-keto-6-methyl-1H-pyrimidin-2-yl)benzyl]-(2-thenyl)ammonium Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)C2=CC=C(C=C2)C[NH+](CCO)CC3=CC=CS3

Isomeric SMILES

CC1=CC(=O)N=C(N1)C2=CC=C(C=C2)C[NH+](CCO)CC3=CC=CS3

InChI

InChI=1S/C19H21N3O2S/c1-14-11-18(24)21-19(20-14)16-6-4-15(5-7-16)12-22(8-9-23)13-17-3-2-10-25-17/h2-7,10-11,23H,8-9,12-13H2,1H3,(H,20,21,24)/p+1