N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide Openeye Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-morpholinosulfonyl-1H-pyrrole-2-carboxamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-4-(4-morpholinylsulfonyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide Traditional Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-morpholinosulfonyl-1H-pyrrole-2-carboxamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC(=CN2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC(=CN2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N5O4S/c1-17-18(16-27(25-17)19-7-3-2-4-8-19)6-5-9-23-22(28)21-14-20(15-24-21)32(29,30)26-10-12-31-13-11-26/h2-4,7-8,14-16,24H,5-6,9-13H2,1H3,(H,23,28)