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

Systemtic Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-butanamide Openeye Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenyl-butanamide CAS Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylbutanamide IUPAC Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylbutanamide Traditional Name: 3-phenyl-N-(5-veratryl-1,3,4-thiadiazol-2-yl)butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NN=C(S1)CC2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)NC1=NN=C(S1)CC2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S/c1-14(16-7-5-4-6-8-16)11-19(25)22-21-24-23-20(28-21)13-15-9-10-17(26-2)18(12-15)27-3/h4-10,12,14H,11,13H2,1-3H3,(H,22,24,25)