N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(1,3-thiazol-2-yl)-5-thiophen-3-yl-pyrimidin-2-amine

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(1,3-thiazol-2-yl)-5-thiophen-3-yl-pyrimidin-2-amine Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-thiazol-2-yl-5-(3-thienyl)pyrimidin-2-amine CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(2-thiazolyl)-5-(3-thiophenyl)-2-pyrimidinamine IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(1,3-thiazol-2-yl)-5-thiophen-3-ylpyrimidin-2-amine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[4-thiazol-2-yl-5-(3-thienyl)pyrimidin-2-yl]amine Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC3=NC=C(C(=N3)C4=NC=CS4)C5=CSC=C5

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC3=NC=C(C(=N3)C4=NC=CS4)C5=CSC=C5

InChI

InChI=1S/C21H18N4O2S2/c1-13(14-2-3-17-18(10-14)27-7-6-26-17)24-21-23-11-16(15-4-8-28-12-15)19(25-21)20-22-5-9-29-20/h2-5,8-13H,6-7H2,1H3,(H,23,24,25)