N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]phenyl]butanamide

Systemtic Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]phenyl]butanamide Openeye Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]phenyl]butanamide CAS Name: N-[4-[[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]sulfamoyl]phenyl]butanamide IUPAC Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-ylethyl]sulfamoyl]phenyl]butanamide Traditional Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]phenyl]butyramide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C22H31N3O3S2/c1-2-7-22(26)24-19-8-10-20(11-9-19)30(27,28)23-16-21(18-12-15-29-17-18)25-13-5-3-4-6-14-25/h8-12,15,17,21,23H,2-7,13-14,16H2,1H3,(H,24,26)