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

Systemtic Name: [5-(3-chlorophenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(quinolin-2-ylmethyl)pyrrol-3-yl]methanol Openeye Name: [5-(3-chlorophenyl)sulfanyl-4-isopropyl-2-methyl-1-(2-quinolylmethyl)pyrrol-3-yl]methanol CAS Name: [5-[(3-chlorophenyl)thio]-2-methyl-4-propan-2-yl-1-(2-quinolinylmethyl)-3-pyrrolyl]methanol IUPAC Name: [5-(3-chlorophenyl)sulfanyl-2-methyl-4-propan-2-yl-1-(quinolin-2-ylmethyl)pyrrol-3-yl]methanol Traditional Name: [5-[(3-chlorophenyl)thio]-4-isopropyl-2-methyl-1-(2-quinolylmethyl)pyrrol-3-yl]methanol Formula: C25H25ClN2OS MolecularWeight: 436.9968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=NC3=CC=CC=C3C=C2)SC4=CC(=CC=C4)Cl)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC2=NC3=CC=CC=C3C=C2)SC4=CC(=CC=C4)Cl)C(C)C)CO

InChI

InChI=1S/C25H25ClN2OS/c1-16(2)24-22(15-29)17(3)28(25(24)30-21-9-6-8-19(26)13-21)14-20-12-11-18-7-4-5-10-23(18)27-20/h4-13,16,29H,14-15H2,1-3H3