4-(4-chloranyl-2-methyl-phenoxy)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C22H24ClN3O2S2 MolecularWeight: 462.02786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NN=C(S2)SCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=NN=C(S2)SCCCC3=CC=CC=C3

InChI

InChI=1S/C22H24ClN3O2S2/c1-16-15-18(23)11-12-19(16)28-13-5-10-20(27)24-21-25-26-22(30-21)29-14-6-9-17-7-3-2-4-8-17/h2-4,7-8,11-12,15H,5-6,9-10,13-14H2,1H3,(H,24,25,27)