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

Systemtic Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide Openeye Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide CAS Name: N-[2-[(3,4-dichlorophenyl)methylthio]-1,3-benzothiazol-6-yl]butanamide IUPAC Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]butanamide Traditional Name: N-[2-[(3,4-dichlorobenzyl)thio]-1,3-benzothiazol-6-yl]butyramide Formula: C18H16Cl2N2OS2 MolecularWeight: 411.36844

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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)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H16Cl2N2OS2/c1-2-3-17(23)21-12-5-7-15-16(9-12)25-18(22-15)24-10-11-4-6-13(19)14(20)8-11/h4-9H,2-3,10H2,1H3,(H,21,23)