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

Systemtic Name: 5-[1-(1,3-benzodioxol-5-yl)pyrazol-3-yl]-4-methyl-N-(phenylmethyl)-1,3-thiazol-2-amine Openeye Name: 5-[1-(1,3-benzodioxol-5-yl)pyrazol-3-yl]-N-benzyl-4-methyl-thiazol-2-amine CAS Name: 5-[1-(1,3-benzodioxol-5-yl)-3-pyrazolyl]-4-methyl-N-(phenylmethyl)-2-thiazolamine IUPAC Name: 5-[1-(1,3-benzodioxol-5-yl)pyrazol-3-yl]-N-benzyl-4-methyl-1,3-thiazol-2-amine Traditional Name: [5-[1-(1,3-benzodioxol-5-yl)pyrazol-3-yl]-4-methyl-thiazol-2-yl]-benzyl-amine Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCC2=CC=CC=C2)C3=NN(C=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CC=CC=C2)C3=NN(C=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18N4O2S/c1-14-20(28-21(23-14)22-12-15-5-3-2-4-6-15)17-9-10-25(24-17)16-7-8-18-19(11-16)27-13-26-18/h2-11H,12-13H2,1H3,(H,22,23)