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

Systemtic Name: N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-thiophen-3-yl-propanamide Openeye Name: N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-(3-thienyl)propanamide CAS Name: N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-(3-thiophenyl)propanamide IUPAC Name: N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-thiophen-3-ylpropanamide Traditional Name: N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-3-(3-thienyl)propionamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CSC=C3

Isomeric SMILES

C1CCC(=NCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CSC=C3

InChI

InChI=1S/C19H23N3O3S2/c23-19(10-5-15-11-13-26-14-15)21-16-6-8-17(9-7-16)27(24,25)22-18-4-2-1-3-12-20-18/h6-9,11,13-14H,1-5,10,12H2,(H,20,22)(H,21,23)