2-ethyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]butanamide

Systemtic Name: 2-ethyl-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]butanamide Openeye Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-2-ethyl-butanamide CAS Name: 2-ethyl-N-[2-(phenylmethylthio)-1,3-benzothiazol-6-yl]butanamide IUPAC Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-2-ethylbutanamide Traditional Name: N-[2-(benzylthio)-1,3-benzothiazol-6-yl]-2-ethyl-butyramide Formula: C20H22N2OS2 MolecularWeight: 370.53148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2OS2/c1-3-15(4-2)19(23)21-16-10-11-17-18(12-16)25-20(22-17)24-13-14-8-6-5-7-9-14/h5-12,15H,3-4,13H2,1-2H3,(H,21,23)