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

Systemtic Name: [5-(3-methoxyphenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [4-isopropyl-5-(3-methoxyphenyl)sulfanyl-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol CAS Name: [5-[(3-methoxyphenyl)thio]-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolyl]methanol IUPAC Name: [5-(3-methoxyphenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [4-isopropyl-5-[(3-methoxyphenyl)thio]-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC=CC(=C3)OC)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC=CC(=C3)OC)C(C)C)CO

InChI

InChI=1S/C22H26N2O2S/c1-15(2)21-20(14-25)16(3)24(13-17-8-10-23-11-9-17)22(21)27-19-7-5-6-18(12-19)26-4/h5-12,15,25H,13-14H2,1-4H3