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

Systemtic Name: 3-[(4-propan-2-ylphenoxy)methyl]-5-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopropylphenoxy)methyl]-5-[[2-(3-thienyl)thiazol-4-yl]methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-propan-2-ylphenoxy)methyl]-5-[[2-(3-thiophenyl)-4-thiazolyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-propan-2-ylphenoxy)methyl]-5-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isopropylphenoxy)methyl]-5-[[2-(3-thienyl)thiazol-4-yl]methylthio]-1,2,4-triazol-4-yl]amine Formula: C20H21N5OS3 MolecularWeight: 443.60864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C20H21N5OS3/c1-13(2)14-3-5-17(6-4-14)26-9-18-23-24-20(25(18)21)29-12-16-11-28-19(22-16)15-7-8-27-10-15/h3-8,10-11,13H,9,12,21H2,1-2H3