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

Systemtic Name: 4-[[5-(4-chlorophenyl)-2-methyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]thiomorpholine Openeye Name: 4-[[5-(4-chlorophenyl)-1-(4-isopropylphenyl)-2-methyl-pyrrol-3-yl]methyl]thiomorpholine CAS Name: 4-[[5-(4-chlorophenyl)-2-methyl-1-(4-propan-2-ylphenyl)-3-pyrrolyl]methyl]thiomorpholine IUPAC Name: 4-[[5-(4-chlorophenyl)-2-methyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]methyl]thiomorpholine Traditional Name: 4-[[5-(4-chlorophenyl)-2-methyl-1-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)C(C)C)C3=CC=C(C=C3)Cl)CN4CCSCC4

Isomeric SMILES

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

InChI

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