1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C19H21N3OS3 MolecularWeight: 403.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CSC3=NN=C(S3)SC

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CSC3=NN=C(S3)SC

InChI

InChI=1S/C19H21N3OS3/c1-13-11-16(17(23)12-25-19-21-20-18(24-3)26-19)14(2)22(13)10-9-15-7-5-4-6-8-15/h4-8,11H,9-10,12H2,1-3H3