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

Systemtic Name: 3-chloranyl-N-[3-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)amino]-2-oxidanyl-propyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide Openeye Name: 3-chloro-N-[3-(3-chloro-4-pyrrolidin-1-yl-anilino)-2-hydroxy-propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide CAS Name: 3-chloro-N-[3-[3-chloro-4-(1-pyrrolidinyl)anilino]-2-hydroxypropyl]-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: 3-chloro-N-[3-(3-chloro-4-pyrrolidin-1-ylanilino)-2-hydroxypropyl]-6-sulfanylidenecyclohexa-1,3-diene-1-carboxamide Traditional Name: 3-chloro-N-[3-(3-chloro-4-pyrrolidino-anilino)-2-hydroxy-propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide Formula: C20H23Cl2N3O2S MolecularWeight: 440.38652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NCC(CNC(=O)C3=CC(=CCC3=S)Cl)O)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NCC(CNC(=O)C3=CC(=CCC3=S)Cl)O)Cl

InChI

InChI=1S/C20H23Cl2N3O2S/c21-13-3-6-19(28)16(9-13)20(27)24-12-15(26)11-23-14-4-5-18(17(22)10-14)25-7-1-2-8-25/h3-5,9-10,15,23,26H,1-2,6-8,11-12H2,(H,24,27)