N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-chloranyl-2-methyl-phenoxy)butanamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-chloranyl-2-methyl-phenoxy)butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-4-(4-chloro-2-methylphenoxy)butanamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-chloro-2-methylphenoxy)butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C17H22ClN3O2S2 MolecularWeight: 399.95848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C17H22ClN3O2S2/c1-4-12(3)24-17-21-20-16(25-17)19-15(22)6-5-9-23-14-8-7-13(18)10-11(14)2/h7-8,10,12H,4-6,9H2,1-3H3,(H,19,20,22)