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

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-(5-veratryl-1,3,4-thiadiazol-2-yl)butyramide Formula: C21H21Cl2N3O4S MolecularWeight: 482.38014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C21H21Cl2N3O4S/c1-28-17-7-5-13(10-18(17)29-2)11-20-25-26-21(31-20)24-19(27)4-3-9-30-16-8-6-14(22)12-15(16)23/h5-8,10,12H,3-4,9,11H2,1-2H3,(H,24,26,27)