2,6-bis(azanyl)-4-(6-bromanyl-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile

Systemtic Name: 2,6-bis(azanyl)-4-(6-bromanyl-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile Openeye Name: 2,6-diamino-4-(6-bromo-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile CAS Name: 2,6-diamino-4-(6-bromo-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile IUPAC Name: 2,6-diamino-4-(6-bromo-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile Traditional Name: 2,6-diamino-4-(6-bromo-1,3-benzodioxol-5-yl)-4H-thiopyran-3,5-dicarbonitrile Formula: C14H9BrN4O2S MolecularWeight: 377.21586

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3C(=C(SC(=C3C#N)N)N)C#N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3C(=C(SC(=C3C#N)N)N)C#N)Br

InChI

InChI=1S/C14H9BrN4O2S/c15-9-2-11-10(20-5-21-11)1-6(9)12-7(3-16)13(18)22-14(19)8(12)4-17/h1-2,12H,5,18-19H2