4-chloranyl-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[3-(methylthio)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(3-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[3-(methylthio)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C18H19ClN2O3S2 MolecularWeight: 410.93806

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H19ClN2O3S2/c1-25-15-6-4-5-14(12-15)20-18(22)13-7-8-16(19)17(11-13)26(23,24)21-9-2-3-10-21/h4-8,11-12H,2-3,9-10H2,1H3,(H,20,22)