2-chloranyl-N-[4-(phenylsulfanylmethyl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(phenylsulfanylmethyl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-(phenylsulfanylmethyl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[4-[(phenylthio)methyl]phenyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[4-(phenylsulfanylmethyl)phenyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-[(phenylthio)methyl]phenyl]-5-pyrrolidinosulfonyl-benzamide Formula: C24H23ClN2O3S2 MolecularWeight: 487.03402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C24H23ClN2O3S2/c25-23-13-12-21(32(29,30)27-14-4-5-15-27)16-22(23)24(28)26-19-10-8-18(9-11-19)17-31-20-6-2-1-3-7-20/h1-3,6-13,16H,4-5,14-15,17H2,(H,26,28)