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

Systemtic Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-ethylsulfanyl-benzamide Openeye Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-ethylsulfanyl-benzamide CAS Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-(ethylthio)benzamide IUPAC Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-ethylsulfanylbenzamide Traditional Name: 2-(ethylthio)-N-(5-veratryl-1,3,4-thiadiazol-2-yl)benzamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NC2=NN=C(S2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC2=NN=C(S2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N3O3S2/c1-4-27-17-8-6-5-7-14(17)19(24)21-20-23-22-18(28-20)12-13-9-10-15(25-2)16(11-13)26-3/h5-11H,4,12H2,1-3H3,(H,21,23,24)