2-(1,3-benzodioxol-5-yl)-4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(1,3-benzodioxol-5-yl)thiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-4-[[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-2-(1,3-benzodioxol-5-yl)thiazole Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC2=CSC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC2=CSC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18N4O2S2/c1-3-7-22-16(4-2)20-21-18(22)26-10-13-9-25-17(19-13)12-5-6-14-15(8-12)24-11-23-14/h3,5-6,8-9H,1,4,7,10-11H2,2H3