2-[[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile Openeye Name: 2-[[[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]amino]methylene]propanedinitrile CAS Name: 2-[[[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]amino]methylidene]propanedinitrile IUPAC Name: 2-[[[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile Traditional Name: 2-[[[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]amino]methylene]malononitrile Formula: C14H8N4O2S MolecularWeight: 296.30392

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC=C(C#N)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC=C(C#N)C#N

InChI

InChI=1S/C14H8N4O2S/c15-4-9(5-16)6-17-14-18-11(7-21-14)10-1-2-12-13(3-10)20-8-19-12/h1-3,6-7H,8H2,(H,17,18)