N-[4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[oxo-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[4-(1,2,4-triazol-1-ylmethyl)benzyl]carbamoyl]phenyl]-2-furamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H19N5O3/c28-21(18-7-9-19(10-8-18)26-22(29)20-2-1-11-30-20)24-12-16-3-5-17(6-4-16)13-27-15-23-14-25-27/h1-11,14-15H,12-13H2,(H,24,28)(H,26,29)