N-[(2S)-butan-2-yl]-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-yl-pyrrole-2-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-yl-pyrrole-2-carboxamide Openeye Name: 3,5-dimethyl-N-[(1S)-1-methylpropyl]-4-morpholino-1-(m-tolylmethyl)pyrrole-2-carboxamide CAS Name: N-[(2S)-butan-2-yl]-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-(4-morpholinyl)-2-pyrrolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-ylpyrrole-2-carboxamide Traditional Name: 3,5-dimethyl-1-(3-methylbenzyl)-N-[(1S)-1-methylpropyl]-4-morpholino-pyrrole-2-carboxamide Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C(=C(N1CC2=CC=CC(=C2)C)C)N3CCOCC3)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C(C(=C(N1CC2=CC=CC(=C2)C)C)N3CCOCC3)C

InChI

InChI=1S/C23H33N3O2/c1-6-17(3)24-23(27)22-18(4)21(25-10-12-28-13-11-25)19(5)26(22)15-20-9-7-8-16(2)14-20/h7-9,14,17H,6,10-13,15H2,1-5H3,(H,24,27)/t17-/m0/s1