2-phenylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 2-phenylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 2-phenylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]propanamide CAS Name: 2-(phenylthio)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 2-phenylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 2-(phenylthio)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]propionamide Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(S1)S(=O)(=O)N2CCCC2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(S1)S(=O)(=O)N2CCCC2)SC3=CC=CC=C3

InChI

InChI=1S/C18H22N2O3S3/c1-14(24-15-7-3-2-4-8-15)18(21)19-13-16-9-10-17(25-16)26(22,23)20-11-5-6-12-20/h2-4,7-10,14H,5-6,11-13H2,1H3,(H,19,21)