4-azanyl-3-(1,3-benzodioxol-5-ylmethyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-3-(1,3-benzodioxol-5-ylmethyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-3-(1,3-benzodioxol-5-ylmethyl)-2-thioxo-thiazole-5-carboxamide CAS Name: 4-amino-3-(1,3-benzodioxol-5-ylmethyl)-2-sulfanylidene-5-thiazolecarboxamide IUPAC Name: 4-amino-3-(1,3-benzodioxol-5-ylmethyl)-2-sulfanylidene-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-3-piperonyl-2-thioxo-4-thiazoline-5-carboxamide Formula: C12H11N3O3S2 MolecularWeight: 309.36404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=C(SC3=S)C(=O)N)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=C(SC3=S)C(=O)N)N

InChI

InChI=1S/C12H11N3O3S2/c13-10-9(11(14)16)20-12(19)15(10)4-6-1-2-7-8(3-6)18-5-17-7/h1-3H,4-5,13H2,(H2,14,16)