N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-(p-tolylthio)butyramide Formula: C24H23ClN2O2S2 MolecularWeight: 471.03462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC(=C4S3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC(=C4S3)Cl)C

InChI

InChI=1S/C24H23ClN2O2S2/c1-16-7-10-19(11-8-16)30-14-4-6-21(28)27(15-18-5-3-13-29-18)24-26-22-17(2)9-12-20(25)23(22)31-24/h3,5,7-13H,4,6,14-15H2,1-2H3