N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(methylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-3-[(methylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-3-[(methylthio)methyl]coumarilamide Formula: C23H23N3O2S MolecularWeight: 405.51262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC

InChI

InChI=1S/C23H23N3O2S/c1-3-16-8-10-17(11-9-16)14-26-21(12-13-24-26)25-23(27)22-19(15-29-2)18-6-4-5-7-20(18)28-22/h4-13H,3,14-15H2,1-2H3,(H,25,27)