N-[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]-1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]-1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C(C)C)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H31N3O4S/c1-5-17-6-8-18(9-7-17)21(16(2)3)23-22(26)20-14-19(15-24(20)4)30(27,28)25-10-12-29-13-11-25/h6-9,14-16,21H,5,10-13H2,1-4H3,(H,23,26)/t21-/m1/s1