N'-(4-methyl-2-nitro-phenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]ethanediamide

Systemtic Name: N'-(4-methyl-2-nitro-phenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]ethanediamide Openeye Name: N'-(4-methyl-2-nitro-phenyl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]oxamide CAS Name: N'-(4-methyl-2-nitrophenyl)-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]oxamide IUPAC Name: N'-(4-methyl-2-nitrophenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]oxamide Traditional Name: N'-(4-methyl-2-nitro-phenyl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]oxamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC(C2=CC=CS2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(=O)NC[C@@H](C2=CC=CS2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-13-4-5-14(15(11-13)23(26)27)21-19(25)18(24)20-12-16(17-3-2-10-29-17)22-6-8-28-9-7-22/h2-5,10-11,16H,6-9,12H2,1H3,(H,20,24)(H,21,25)/t16-/m0/s1