N-[2-[[3-(1,3-dithian-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[[3-(1,3-dithian-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[3-(1,3-dithian-2-yl)anilino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[3-(1,3-dithian-2-yl)anilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[3-(1,3-dithian-2-yl)anilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[3-(1,3-dithian-2-yl)anilino]-2-keto-ethyl]-piperonylamide Formula: C20H20N2O4S2 MolecularWeight: 416.5138

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O4S2/c23-18(11-21-19(24)13-5-6-16-17(10-13)26-12-25-16)22-15-4-1-3-14(9-15)20-27-7-2-8-28-20/h1,3-6,9-10,20H,2,7-8,11-12H2,(H,21,24)(H,22,23)