N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-(p-tolylthio)propionamide Formula: C23H21ClN2O2S2 MolecularWeight: 457.00804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC(=C4C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC(=C4C)Cl

InChI

InChI=1S/C23H21ClN2O2S2/c1-15-5-7-18(8-6-15)29-13-11-21(27)26(14-17-4-3-12-28-17)23-25-22-16(2)19(24)9-10-20(22)30-23/h3-10,12H,11,13-14H2,1-2H3