N-(2-ethylhexyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide

Systemtic Name: N-(2-ethylhexyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: N-(2-ethylhexyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: N-(2-ethylhexyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(2-phenyl-4-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: N-(2-ethylhexyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: N-(2-ethylhexyl)-2-methyl-1-p-anisyl-5-(2-phenylthiazol-4-yl)pyrrole-3-carboxamide Formula: C31H37N3O2S MolecularWeight: 515.70938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CC4=CC=C(C=C4)OC)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=CC=CC=C3)CC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C31H37N3O2S/c1-5-7-11-23(6-2)19-32-30(35)27-18-29(28-21-37-31(33-28)25-12-9-8-10-13-25)34(22(27)3)20-24-14-16-26(36-4)17-15-24/h8-10,12-18,21,23H,5-7,11,19-20H2,1-4H3,(H,32,35)