3-chloranyl-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl]benzothiophene-2-carboxamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)N4CCOCC4

InChI

InChI=1S/C22H28ClN3O3S/c23-19-16-6-2-3-7-17(16)30-20(19)21(28)24-14-18(27)25-15-22(8-4-1-5-9-22)26-10-12-29-13-11-26/h2-3,6-7H,1,4-5,8-15H2,(H,24,28)(H,25,27)