5-ethoxy-4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-2-nitro-benzamide

Systemtic Name: 5-ethoxy-4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-2-nitro-benzamide Openeye Name: 5-ethoxy-4-methoxy-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide CAS Name: 5-ethoxy-4-methoxy-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-2-nitrobenzamide IUPAC Name: 5-ethoxy-4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-nitrobenzamide Traditional Name: 5-ethoxy-4-methoxy-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NCC(C2=CC=CS2)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC[C@@H](C2=CC=CS2)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H25N3O6S/c1-3-29-18-11-14(15(23(25)26)12-17(18)27-2)20(24)21-13-16(19-5-4-10-30-19)22-6-8-28-9-7-22/h4-5,10-12,16H,3,6-9,13H2,1-2H3,(H,21,24)/t16-/m0/s1