N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[2-(methylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[[2-keto-2-(methylamino)ethyl]thio]-4-phenyl-thiazol-5-yl]-piperonylamide Formula: C20H17N3O4S2 MolecularWeight: 427.49668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)CSC1=NC(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O4S2/c1-21-16(24)10-28-20-22-17(12-5-3-2-4-6-12)19(29-20)23-18(25)13-7-8-14-15(9-13)27-11-26-14/h2-9H,10-11H2,1H3,(H,21,24)(H,23,25)