N-[2-[(4-ethylphenyl)carbonylamino]ethyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[(4-ethylphenyl)carbonylamino]ethyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[2-[(4-ethylbenzoyl)amino]ethyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N-[2-[[(4-ethylphenyl)-oxomethyl]amino]ethyl]-1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[2-[(4-ethylbenzoyl)amino]ethyl]-1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[2-[(4-ethylbenzoyl)amino]ethyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H28N4O5S/c1-3-16-4-6-17(7-5-16)20(26)22-8-9-23-21(27)19-14-18(15-24(19)2)31(28,29)25-10-12-30-13-11-25/h4-7,14-15H,3,8-13H2,1-2H3,(H,22,26)(H,23,27)