N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-5-[1-(2-thiophen-2-ylethyl)pyrazol-3-yl]-1,3-thiazol-2-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-5-[1-(2-thiophen-2-ylethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-5-[1-[2-(2-thienyl)ethyl]pyrazol-3-yl]thiazol-2-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-5-[1-(2-thiophen-2-ylethyl)-3-pyrazolyl]-2-thiazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-5-[1-(2-thiophen-2-ylethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Traditional Name: [4-methyl-5-[1-[2-(2-thienyl)ethyl]pyrazol-3-yl]thiazol-2-yl]-piperonyl-amine Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCC2=CC3=C(C=C2)OCO3)C4=NN(C=C4)CCC5=CC=CS5

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CC3=C(C=C2)OCO3)C4=NN(C=C4)CCC5=CC=CS5

InChI

InChI=1S/C21H20N4O2S2/c1-14-20(17-7-9-25(24-17)8-6-16-3-2-10-28-16)29-21(23-14)22-12-15-4-5-18-19(11-15)27-13-26-18/h2-5,7,9-11H,6,8,12-13H2,1H3,(H,22,23)