2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]ethanone

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]ethanone Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-[2-phenyl-3-(p-tolylsulfonyl)imidazolidin-1-yl]ethanone CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-[3-(4-methylphenyl)sulfonyl-2-phenyl-1-imidazolidinyl]ethanone IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylphenyl)sulfonyl-2-phenylimidazolidin-1-yl]ethanone Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(2-phenyl-3-tosyl-imidazolidin-1-yl)ethanone Formula: C25H22ClN3O3S3 MolecularWeight: 544.10848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2C3=CC=CC=C3)C(=O)CSC4=NC5=C(S4)C=CC(=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2C3=CC=CC=C3)C(=O)CSC4=NC5=C(S4)C=CC(=C5)Cl

InChI

InChI=1S/C25H22ClN3O3S3/c1-17-7-10-20(11-8-17)35(31,32)29-14-13-28(24(29)18-5-3-2-4-6-18)23(30)16-33-25-27-21-15-19(26)9-12-22(21)34-25/h2-12,15,24H,13-14,16H2,1H3