[2-methyl-5-methylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol

Systemtic Name: [2-methyl-5-methylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [4-isopropyl-2-methyl-5-methylsulfanyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol CAS Name: [2-methyl-5-(methylthio)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolyl]methanol IUPAC Name: [2-methyl-5-methylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [4-isopropyl-2-methyl-5-(methylthio)-1-(4-pyridylmethyl)pyrrol-3-yl]methanol Formula: C16H22N2OS MolecularWeight: 290.42368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC)C(C)C)CO

InChI

InChI=1S/C16H22N2OS/c1-11(2)15-14(10-19)12(3)18(16(15)20-4)9-13-5-7-17-8-6-13/h5-8,11,19H,9-10H2,1-4H3