2-(1,3-benzoxazol-2-ylsulfanyl)-N-(heptan-4-ylideneamino)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(heptan-4-ylideneamino)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(1-propylbutylideneamino)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(heptan-4-ylideneamino)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(heptan-4-ylideneamino)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(1-propylbutylideneamino)acetamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)CSC1=NC2=CC=CC=C2O1)CCC

Isomeric SMILES

CCCC(=NNC(=O)CSC1=NC2=CC=CC=C2O1)CCC

InChI

InChI=1S/C16H21N3O2S/c1-3-7-12(8-4-2)18-19-15(20)11-22-16-17-13-9-5-6-10-14(13)21-16/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,19,20)