N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2,4-bis(chloranyl)-5-methyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2,4-bis(chloranyl)-5-methyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2,4-dichloro-5-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2,4-dichloro-5-methylbenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2,4-dichloro-5-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2,4-dichloro-5-methyl-benzenesulfonamide Formula: C19H24Cl2N2O2S2 MolecularWeight: 447.44206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C19H24Cl2N2O2S2/c1-14-10-19(17(21)11-16(14)20)27(24,25)22-12-18(15-6-9-26-13-15)23-7-4-2-3-5-8-23/h6,9-11,13,18,22H,2-5,7-8,12H2,1H3