N-(2-prop-2-enylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-prop-2-enylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-allylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(prop-2-enylthio)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-prop-2-enylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(allylthio)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H22N2O3S2/c1-2-14-26-19-11-4-3-10-18(19)21-20(23)16-8-7-9-17(15-16)27(24,25)22-12-5-6-13-22/h2-4,7-11,15H,1,5-6,12-14H2,(H,21,23)