N-(1,3-benzothiazol-6-yl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-6-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(1,3-benzothiazol-6-yl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-6-yl)-3-(p-tolylthio)propionamide Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C17H16N2OS2/c1-12-2-5-14(6-3-12)21-9-8-17(20)19-13-4-7-15-16(10-13)22-11-18-15/h2-7,10-11H,8-9H2,1H3,(H,19,20)