N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,5-dimethyl-isoxazole-4-sulfonamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-3,5-dimethyl-4-isoxazolesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,5-dimethyl-isoxazole-4-sulfonamide Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C17H25N3O3S2/c1-13-17(14(2)23-19-13)25(21,22)18-11-16(15-7-10-24-12-15)20-8-5-3-4-6-9-20/h7,10,12,16,18H,3-6,8-9,11H2,1-2H3