N-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]-N-[3-(4-morpholinyl)propyl]propanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-(p-tolylthio)propionamide Formula: C24H28ClN3O2S2 MolecularWeight: 490.08102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C24H28ClN3O2S2/c1-18-6-8-19(9-7-18)31-17-10-22(29)28(12-3-11-27-13-15-30-16-14-27)24-26-23-20(25)4-2-5-21(23)32-24/h2,4-9H,3,10-17H2,1H3