N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]-N-[2-(4-morpholinyl)ethyl]propanamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-(p-tolylthio)propionamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CCN2CCOCC2)C3=NC4=C(C=CC=C4S3)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCN2CCOCC2)C3=NC4=C(C=CC=C4S3)C

InChI

InChI=1S/C24H29N3O2S2/c1-18-6-8-20(9-7-18)30-17-10-22(28)27(12-11-26-13-15-29-16-14-26)24-25-23-19(2)4-3-5-21(23)31-24/h3-9H,10-17H2,1-2H3