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

Systemtic Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-methyl-butanamide Openeye Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-methyl-butanamide CAS Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-methylbutanamide IUPAC Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-methylbutanamide Traditional Name: 2-methyl-N-(5-veratryl-1,3,4-thiadiazol-2-yl)butyramide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=NN=C(S1)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCC(C)C(=O)NC1=NN=C(S1)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H21N3O3S/c1-5-10(2)15(20)17-16-19-18-14(23-16)9-11-6-7-12(21-3)13(8-11)22-4/h6-8,10H,5,9H2,1-4H3,(H,17,19,20)