1-[5-[3,5-bis(chloranyl)phenyl]sulfanyl-3-(hydroxymethyl)-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-2-yl]propan-2-ol

Systemtic Name: 1-[5-[3,5-bis(chloranyl)phenyl]sulfanyl-3-(hydroxymethyl)-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-2-yl]propan-2-ol Openeye Name: 1-[5-(3,5-dichlorophenyl)sulfanyl-3-(hydroxymethyl)-4-isopropyl-1-(4-pyridylmethyl)pyrrol-2-yl]propan-2-ol CAS Name: 1-[5-[(3,5-dichlorophenyl)thio]-3-(hydroxymethyl)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-pyrrolyl]-2-propanol IUPAC Name: 1-[5-(3,5-dichlorophenyl)sulfanyl-3-(hydroxymethyl)-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrol-2-yl]propan-2-ol Traditional Name: 1-[5-[(3,5-dichlorophenyl)thio]-4-isopropyl-3-methylol-1-(4-pyridylmethyl)pyrrol-2-yl]propan-2-ol Formula: C23H26Cl2N2O2S MolecularWeight: 465.43574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=C1CO)CC(C)O)CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CC(C)C1=C(N(C(=C1CO)CC(C)O)CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C23H26Cl2N2O2S/c1-14(2)22-20(13-28)21(8-15(3)29)27(12-16-4-6-26-7-5-16)23(22)30-19-10-17(24)9-18(25)11-19/h4-7,9-11,14-15,28-29H,8,12-13H2,1-3H3