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

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-chloro-2-methyl-phenoxy)butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-4-(4-chloro-2-methyl-phenoxy)butyramide Formula: C16H18ClN3O2S2 MolecularWeight: 383.91602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NN=C(S2)SCC=C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NN=C(S2)SCC=C

InChI

InChI=1S/C16H18ClN3O2S2/c1-3-9-23-16-20-19-15(24-16)18-14(21)5-4-8-22-13-7-6-12(17)10-11(13)2/h3,6-7,10H,1,4-5,8-9H2,2H3,(H,18,19,21)