3-cyano-N-[5-(diethylamino)pentan-2-yl]-1-(2-phenoxyphenyl)pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-[5-(diethylamino)pentan-2-yl]-1-(2-phenoxyphenyl)pyrrole-2-carboxamide Openeye Name: 3-cyano-N-[4-(diethylamino)-1-methyl-butyl]-1-(2-phenoxyphenyl)pyrrole-2-carboxamide CAS Name: 3-cyano-N-[5-(diethylamino)pentan-2-yl]-1-(2-phenoxyphenyl)-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-[5-(diethylamino)pentan-2-yl]-1-(2-phenoxyphenyl)pyrrole-2-carboxamide Traditional Name: 3-cyano-N-[4-(diethylamino)-1-methyl-butyl]-1-(2-phenoxyphenyl)pyrrole-2-carboxamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=C(C=CN1C2=CC=CC=C2OC3=CC=CC=C3)C#N

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)C1=C(C=CN1C2=CC=CC=C2OC3=CC=CC=C3)C#N

InChI

InChI=1S/C27H32N4O2/c1-4-30(5-2)18-11-12-21(3)29-27(32)26-22(20-28)17-19-31(26)24-15-9-10-16-25(24)33-23-13-7-6-8-14-23/h6-10,13-17,19,21H,4-5,11-12,18H2,1-3H3,(H,29,32)