N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methyl-5-[1-(3-thienylmethyl)pyrazol-3-yl]thiazol-2-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methyl-5-[1-(3-thiophenylmethyl)-3-pyrazolyl]-2-thiazolamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methyl-5-[1-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,3-thiazol-2-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[4-methyl-5-[1-(3-thenyl)pyrazol-3-yl]thiazol-2-yl]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)OCCO3)C4=NN(C=C4)CC5=CSC=C5

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CC3=C(C=C2)OCCO3)C4=NN(C=C4)CC5=CSC=C5

InChI

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