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

Systemtic Name: 5-[[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-[[2-(2,4-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[[2-(2,4-dimethoxyphenyl)-4-thiazolyl]methylthio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[[2-(2,4-dimethoxyphenyl)thiazol-4-yl]methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C17H18N4O2S3 MolecularWeight: 406.54542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O2S3/c1-4-7-18-16-20-21-17(26-16)25-10-11-9-24-15(19-11)13-6-5-12(22-2)8-14(13)23-3/h4-6,8-9H,1,7,10H2,2-3H3,(H,18,20)