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

Systemtic Name: [5-(4-ethylphenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [5-(4-ethylphenyl)sulfanyl-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol CAS Name: [5-[(4-ethylphenyl)thio]-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolyl]methanol IUPAC Name: [5-(4-ethylphenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [5-[(4-ethylphenyl)thio]-4-isopropyl-2-methyl-1-(4-pyridylmethyl)pyrrol-3-yl]methanol Formula: C23H28N2OS MolecularWeight: 380.54622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=C(C(=C(N2CC3=CC=NC=C3)C)CO)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=C(C(=C(N2CC3=CC=NC=C3)C)CO)C(C)C

InChI

InChI=1S/C23H28N2OS/c1-5-18-6-8-20(9-7-18)27-23-22(16(2)3)21(15-26)17(4)25(23)14-19-10-12-24-13-11-19/h6-13,16,26H,5,14-15H2,1-4H3