1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one

Systemtic Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[[5-(o-toluidino)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C24H23ClN4OS2 MolecularWeight: 483.04862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN=C(S2)SC(C)C(=O)C3=C(N(C(=C3)C)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NN=C(S2)SC(C)C(=O)C3=C(N(C(=C3)C)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C24H23ClN4OS2/c1-14-7-5-6-8-21(14)26-23-27-28-24(32-23)31-17(4)22(30)20-13-15(2)29(16(20)3)19-11-9-18(25)10-12-19/h5-13,17H,1-4H3,(H,26,27)