4-(4-chlorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]butyramide Formula: C20H21ClN2OS3 MolecularWeight: 437.04154

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=CC=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CSCCN1C2=CC=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2OS3/c1-25-14-12-23-17-5-2-3-6-18(17)27-20(23)22-19(24)7-4-13-26-16-10-8-15(21)9-11-16/h2-3,5-6,8-11H,4,7,12-14H2,1H3