2-[[5-[(3,4-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[[5-[(3,4-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-(3,4-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-pyrrolidino-ethanone Formula: C16H20N4OS2 MolecularWeight: 348.4862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC(=O)N3CCCC3)C

InChI

InChI=1S/C16H20N4OS2/c1-11-5-6-13(9-12(11)2)17-15-18-19-16(23-15)22-10-14(21)20-7-3-4-8-20/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,17,18)