N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Openeye Name: 2-isopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-5-carboxamide CAS Name: N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide IUPAC Name: N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Traditional Name: 2-isopropyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1,3-benzoxazole-5-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2/c1-15(2)22-26-19-12-17(8-9-20(19)29-22)21(28)25-18(16-6-4-3-5-7-16)10-11-27-14-23-13-24-27/h3-9,12-15,18H,10-11H2,1-2H3,(H,25,28)