N-[2-[4-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-[4-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-[4-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-[4-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-[4-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-[4-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]ethyl]-3-(phenylthio)propionamide Formula: C23H27ClN4OS2 MolecularWeight: 475.06968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N3CCN(CC3)CCNC(=O)CCSC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N3CCN(CC3)CCNC(=O)CCSC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H27ClN4OS2/c1-17-19(24)7-8-20-22(17)26-23(31-20)28-14-12-27(13-15-28)11-10-25-21(29)9-16-30-18-5-3-2-4-6-18/h2-8H,9-16H2,1H3,(H,25,29)