N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=NC=NN4

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=NC=NN4

InChI

InChI=1S/C20H19N5O2/c1-3-12(2)14-6-9-17-16(10-14)24-20(27-17)13-4-7-15(8-5-13)23-19(26)18-21-11-22-25-18/h4-12H,3H2,1-2H3,(H,23,26)(H,21,22,25)