N-(furan-2-ylmethyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(2-furylmethyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(2-furanylmethyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(furan-2-ylmethyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(2-furfuryl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C17H14N4O3S MolecularWeight: 354.38306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C(=O)NCC3=CC=CO3)CSC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C(=O)NCC3=CC=CO3)CSC4=NC=NN4

InChI

InChI=1S/C17H14N4O3S/c22-16(18-8-11-4-3-7-23-11)15-13(9-25-17-19-10-20-21-17)12-5-1-2-6-14(12)24-15/h1-7,10H,8-9H2,(H,18,22)(H,19,20,21)