3-chloranyl-N-[2-oxidanyl-3-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]amino]propyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide

Systemtic Name: 3-chloranyl-N-[2-oxidanyl-3-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]amino]propyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide Openeye Name: 3-chloro-N-[2-hydroxy-3-[4-(4-oxo-1-piperidyl)anilino]propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide CAS Name: 3-chloro-N-[2-hydroxy-3-[4-(4-oxo-1-piperidinyl)anilino]propyl]-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: 3-chloro-N-[2-hydroxy-3-[4-(4-oxopiperidin-1-yl)anilino]propyl]-6-sulfanylidenecyclohexa-1,3-diene-1-carboxamide Traditional Name: 3-chloro-N-[2-hydroxy-3-[4-(4-ketopiperidino)anilino]propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=CC=C(C=C2)NCC(CNC(=O)C3=CC(=CCC3=S)Cl)O

Isomeric SMILES

C1CN(CCC1=O)C2=CC=C(C=C2)NCC(CNC(=O)C3=CC(=CCC3=S)Cl)O

InChI

InChI=1S/C21H24ClN3O3S/c22-14-1-6-20(29)19(11-14)21(28)24-13-18(27)12-23-15-2-4-16(5-3-15)25-9-7-17(26)8-10-25/h1-5,11,18,23,27H,6-10,12-13H2,(H,24,28)