2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile Openeye Name: 2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile CAS Name: 2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile IUPAC Name: 2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile Traditional Name: 2-(butylamino)-5-(4-fluorophenyl)-4-methyl-1H-pyrrole-3-carbonitrile Formula: C16H18FN3 MolecularWeight: 271.332623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=C(N1)C2=CC=C(C=C2)F)C)C#N

Isomeric SMILES

CCCCNC1=C(C(=C(N1)C2=CC=C(C=C2)F)C)C#N

InChI

InChI=1S/C16H18FN3/c1-3-4-9-19-16-14(10-18)11(2)15(20-16)12-5-7-13(17)8-6-12/h5-8,19-20H,3-4,9H2,1-2H3