N-[2-(2-chlorophenyl)-2-morpholin-4-yl-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-morpholin-4-yl-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-[2-(2-chlorophenyl)-2-morpholino-ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[2-(2-chlorophenyl)-2-(4-morpholinyl)ethyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-[2-(2-chlorophenyl)-2-morpholino-ethyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(C1=CC=CC=C1Cl)N2CCOCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC(C1=CC=CC=C1Cl)N2CCOCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24ClN3O4S/c1-15(30-17-8-6-16(7-9-17)25(27)28)21(26)23-14-20(24-10-12-29-13-11-24)18-4-2-3-5-19(18)22/h2-9,15,20H,10-14H2,1H3,(H,23,26)