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

Systemtic Name: [2-methyl-5-(4-methylphenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [4-isopropyl-2-methyl-5-(p-tolylsulfanyl)-1-(4-pyridylmethyl)pyrrol-3-yl]methanol CAS Name: [2-methyl-5-[(4-methylphenyl)thio]-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolyl]methanol IUPAC Name: [2-methyl-5-(4-methylphenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [4-isopropyl-2-methyl-5-(p-tolylthio)-1-(4-pyridylmethyl)pyrrol-3-yl]methanol Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=C(N2CC3=CC=NC=C3)C)CO)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=C(N2CC3=CC=NC=C3)C)CO)C(C)C

InChI

InChI=1S/C22H26N2OS/c1-15(2)21-20(14-25)17(4)24(13-18-9-11-23-12-10-18)22(21)26-19-7-5-16(3)6-8-19/h5-12,15,25H,13-14H2,1-4H3