2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfanyl]-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfanyl]-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfanyl]-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)thio]-1-pent-4-ynyl-4-imidazo[4,5-c]pyridinamine IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfanyl]-1-pent-4-ynylimidazo[4,5-c]pyridin-4-amine Traditional Name: [2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)thio]-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-yl]amine Formula: C19H17BrN4O2S MolecularWeight: 445.33288

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCN1C2=C(C(=NC=C2)N)N=C1SC3=C(C=C4C(=C3)OCCO4)Br

Isomeric SMILES

C#CCCCN1C2=C(C(=NC=C2)N)N=C1SC3=C(C=C4C(=C3)OCCO4)Br

InChI

InChI=1S/C19H17BrN4O2S/c1-2-3-4-7-24-13-5-6-22-18(21)17(13)23-19(24)27-16-11-15-14(10-12(16)20)25-8-9-26-15/h1,5-6,10-11H,3-4,7-9H2,(H2,21,22)