4-[[1-(4-chlorophenyl)-2-methyl-5-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]thiomorpholine

Systemtic Name: 4-[[1-(4-chlorophenyl)-2-methyl-5-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]thiomorpholine Openeye Name: 4-[[1-(4-chlorophenyl)-5-(4-isopropylphenyl)-2-methyl-pyrrol-3-yl]methyl]thiomorpholine CAS Name: 4-[[1-(4-chlorophenyl)-2-methyl-5-(4-propan-2-ylphenyl)-3-pyrrolyl]methyl]thiomorpholine IUPAC Name: 4-[[1-(4-chlorophenyl)-2-methyl-5-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]thiomorpholine Traditional Name: 4-[[1-(4-chlorophenyl)-2-methyl-5-p-cumenyl-pyrrol-3-yl]methyl]thiomorpholine Formula: C25H29ClN2S MolecularWeight: 425.02916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(C)C)CN4CCSCC4

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(C)C)CN4CCSCC4

InChI

InChI=1S/C25H29ClN2S/c1-18(2)20-4-6-21(7-5-20)25-16-22(17-27-12-14-29-15-13-27)19(3)28(25)24-10-8-23(26)9-11-24/h4-11,16,18H,12-15,17H2,1-3H3