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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylsulfanyl-propanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-phenylsulfanyl-propanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-3-(phenylthio)propanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-3-phenylsulfanylpropanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-(phenylthio)propionamide Formula: C23H26ClN3O2S2 MolecularWeight: 476.05444

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C23H26ClN3O2S2/c24-19-8-4-9-20-22(19)25-23(31-20)27(12-5-11-26-13-15-29-16-14-26)21(28)10-17-30-18-6-2-1-3-7-18/h1-4,6-9H,5,10-17H2