3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethyl-propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethyl-propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethyl-propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-phenethylpropanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-phenethylpropanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-phenethyl-propionamide Formula: C18H18N2OS2 MolecularWeight: 342.47832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2OS2/c21-17(19-12-10-14-6-2-1-3-7-14)11-13-22-18-20-15-8-4-5-9-16(15)23-18/h1-9H,10-13H2,(H,19,21)