2-(phenylmethyl)-N-(4-pyrazol-1-ylbutan-2-yl)-1,3-benzoxazole-5-carboxamide

Systemtic Name: 2-(phenylmethyl)-N-(4-pyrazol-1-ylbutan-2-yl)-1,3-benzoxazole-5-carboxamide Openeye Name: 2-benzyl-N-(1-methyl-3-pyrazol-1-yl-propyl)-1,3-benzoxazole-5-carboxamide CAS Name: 2-(phenylmethyl)-N-[4-(1-pyrazolyl)butan-2-yl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-benzyl-N-(4-pyrazol-1-ylbutan-2-yl)-1,3-benzoxazole-5-carboxamide Traditional Name: 2-benzyl-N-(1-methyl-3-pyrazol-1-yl-propyl)-1,3-benzoxazole-5-carboxamide Formula: C22H22N4O2 MolecularWeight: 374.43568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)NC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=CC=C4

Isomeric SMILES

CC(CCN1C=CC=N1)NC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-16(10-13-26-12-5-11-23-26)24-22(27)18-8-9-20-19(15-18)25-21(28-20)14-17-6-3-2-4-7-17/h2-9,11-12,15-16H,10,13-14H2,1H3,(H,24,27)