5-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-phenethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-phenethyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[[2-(3,4-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]-N-phenethyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[[2-(3,4-dimethoxyphenyl)-4-thiazolyl]methylthio]-N-phenethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-phenethyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[2-(3,4-dimethoxyphenyl)thiazol-4-yl]methylthio]-1,3,4-thiadiazol-2-yl]-phenethyl-amine Formula: C22H22N4O2S3 MolecularWeight: 470.63068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(S3)NCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(S3)NCCC4=CC=CC=C4)OC

InChI

InChI=1S/C22H22N4O2S3/c1-27-18-9-8-16(12-19(18)28-2)20-24-17(13-29-20)14-30-22-26-25-21(31-22)23-11-10-15-6-4-3-5-7-15/h3-9,12-13H,10-11,14H2,1-2H3,(H,23,25)