2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Openeye Name: 2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-cyclopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)NC(CCN4C=NC=N4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)NC(CCN4C=NC=N4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N5O2/c28-21(17-8-9-19-20(12-17)29-22(26-19)16-6-7-16)25-18(15-4-2-1-3-5-15)10-11-27-14-23-13-24-27/h1-5,8-9,12-14,16,18H,6-7,10-11H2,(H,25,28)