3-cyano-1-(2-methoxyphenyl)-N-[(2S)-3-methylbutan-2-yl]pyrrole-2-carboxamide

Systemtic Name: 3-cyano-1-(2-methoxyphenyl)-N-[(2S)-3-methylbutan-2-yl]pyrrole-2-carboxamide Openeye Name: 3-cyano-N-[(1S)-1,2-dimethylpropyl]-1-(2-methoxyphenyl)pyrrole-2-carboxamide CAS Name: 3-cyano-1-(2-methoxyphenyl)-N-[(2S)-3-methylbutan-2-yl]-2-pyrrolecarboxamide IUPAC Name: 3-cyano-1-(2-methoxyphenyl)-N-[(2S)-3-methylbutan-2-yl]pyrrole-2-carboxamide Traditional Name: 3-cyano-N-[(1S)-1,2-dimethylpropyl]-1-(2-methoxyphenyl)pyrrole-2-carboxamide Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)C1=C(C=CN1C2=CC=CC=C2OC)C#N

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)C1=C(C=CN1C2=CC=CC=C2OC)C#N

InChI

InChI=1S/C18H21N3O2/c1-12(2)13(3)20-18(22)17-14(11-19)9-10-21(17)15-7-5-6-8-16(15)23-4/h5-10,12-13H,1-4H3,(H,20,22)/t13-/m0/s1