N-[2-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethylamino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethylamino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethylamino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethylamino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OCC(CNCCNC(=O)CNC(=O)C2=CC=CS2)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OCC(CNCCNC(=O)CNC(=O)C2=CC=CS2)O

InChI

InChI=1S/C19H22N4O4S/c20-10-14-4-1-2-5-16(14)27-13-15(24)11-21-7-8-22-18(25)12-23-19(26)17-6-3-9-28-17/h1-6,9,15,21,24H,7-8,11-13H2,(H,22,25)(H,23,26)