N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(p-tolylthio)propionamide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=NC3=C(C=CC(=C3S2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=NC3=C(C=CC(=C3S2)C)C

InChI

InChI=1S/C19H20N2OS2/c1-12-4-8-15(9-5-12)23-11-10-16(22)20-19-21-17-13(2)6-7-14(3)18(17)24-19/h4-9H,10-11H2,1-3H3,(H,20,21,22)