2-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-(2-cyanophenyl)-2-sulfanylidene-ethanamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-(2-cyanophenyl)-2-sulfanylidene-ethanamide Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-(2-cyanophenyl)-2-thioxo-acetamide CAS Name: 2-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-(2-cyanophenyl)-2-sulfanylideneacetamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-(2-cyanophenyl)-2-sulfanylideneacetamide Traditional Name: N-(2-cyanophenyl)-2-(homopiperonylamino)-2-thioxo-acetamide Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=S)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=S)C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C18H15N3O3S/c19-10-13-3-1-2-4-14(13)21-17(22)18(25)20-8-7-12-5-6-15-16(9-12)24-11-23-15/h1-6,9H,7-8,11H2,(H,20,25)(H,21,22)