N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]hexanamide

Systemtic Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]hexanamide Openeye Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]hexanamide CAS Name: N-[[(2-phenyl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]hexanamide Traditional Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)thiocarbamoyl]hexanamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-2-3-5-10-18(24)23-20(26)21-15-11-12-17-16(13-15)22-19(25-17)14-8-6-4-7-9-14/h4,6-9,11-13H,2-3,5,10H2,1H3,(H2,21,23,24,26)