N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide

Systemtic Name: N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide Openeye Name: N-[(1S)-2-morpholino-1-phenyl-ethyl]-3-(2-nitro-4-sulfamoyl-anilino)propanamide CAS Name: N-[(1S)-2-(4-morpholinyl)-1-phenylethyl]-3-(2-nitro-4-sulfamoylanilino)propanamide IUPAC Name: N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-3-(2-nitro-4-sulfamoylanilino)propanamide Traditional Name: N-[(1S)-2-morpholino-1-phenyl-ethyl]-3-(2-nitro-4-sulfamoyl-anilino)propionamide Formula: C21H27N5O6S MolecularWeight: 477.53398

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(C2=CC=CC=C2)NC(=O)CCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C[C@H](C2=CC=CC=C2)NC(=O)CCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O6S/c22-33(30,31)17-6-7-18(20(14-17)26(28)29)23-9-8-21(27)24-19(16-4-2-1-3-5-16)15-25-10-12-32-13-11-25/h1-7,14,19,23H,8-13,15H2,(H,24,27)(H2,22,30,31)/t19-/m1/s1