N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]hexanamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]hexanamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]hexanamide CAS Name: N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]hexanamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]hexanamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)hexanamide Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC

Isomeric SMILES

CCCCCC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC

InChI

InChI=1S/C17H23N3O2S/c1-3-5-6-8-16(22)18-12-9-10-13-14(11-12)23-17(19-13)20-15(21)7-4-2/h9-11H,3-8H2,1-2H3,(H,18,22)(H,19,20,21)