N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide Openeye Name: N-[2-(p-tolylmethylsulfanyl)-1,3-benzothiazol-6-yl]butanamide CAS Name: N-[2-[(4-methylphenyl)methylthio]-1,3-benzothiazol-6-yl]butanamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide Traditional Name: N-[2-[(4-methylbenzyl)thio]-1,3-benzothiazol-6-yl]butyramide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2OS2/c1-3-4-18(22)20-15-9-10-16-17(11-15)24-19(21-16)23-12-14-7-5-13(2)6-8-14/h5-11H,3-4,12H2,1-2H3,(H,20,22)