3-(3,4-dimethoxyphenyl)-5-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[[2-(2-thienyl)thiazol-4-yl]methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(2-thiophen-2-yl-4-thiazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(3,4-dimethoxyphenyl)-5-[[2-(2-thienyl)thiazol-4-yl]methylthio]-1,2,4-triazol-4-yl]amine Formula: C18H17N5O2S3 MolecularWeight: 431.55488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(N2N)SCC3=CSC(=N3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(N2N)SCC3=CSC(=N3)C4=CC=CS4)OC

InChI

InChI=1S/C18H17N5O2S3/c1-24-13-6-5-11(8-14(13)25-2)16-21-22-18(23(16)19)28-10-12-9-27-17(20-12)15-4-3-7-26-15/h3-9H,10,19H2,1-2H3