3-methylsulfanyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-methylsulfanyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-methylsulfanyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide CAS Name: 3-(methylthio)-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide IUPAC Name: 3-methylsulfanyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-(methylthio)-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propionamide Formula: C16H23N3O3S2 MolecularWeight: 369.50212

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NCCCCC2

Isomeric SMILES

CSCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NCCCCC2

InChI

InChI=1S/C16H23N3O3S2/c1-23-12-10-16(20)18-13-6-8-14(9-7-13)24(21,22)19-15-5-3-2-4-11-17-15/h6-9H,2-5,10-12H2,1H3,(H,17,19)(H,18,20)