2-chloranyl-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 2-chloranyl-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide Openeye Name: 2-chloro-N-[4-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide CAS Name: 2-chloro-N-[4-[oxo-(2-oxolanylmethylamino)methyl]phenyl]-5-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 2-chloro-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide Traditional Name: 2-chloro-N-[4-(tetrahydrofurfurylcarbamoyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide Formula: C21H20ClN5O3 MolecularWeight: 425.8682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)N4C=NN=C4)Cl

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)N4C=NN=C4)Cl

InChI

InChI=1S/C21H20ClN5O3/c22-19-8-7-16(27-12-24-25-13-27)10-18(19)21(29)26-15-5-3-14(4-6-15)20(28)23-11-17-2-1-9-30-17/h3-8,10,12-13,17H,1-2,9,11H2,(H,23,28)(H,26,29)