N-tert-butyl-4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-tert-butyl-4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-tert-butyl-4-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-tert-butyl-4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]benzenesulfonamide Formula: C20H26ClN3O3S2 MolecularWeight: 456.02174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C20H26ClN3O3S2/c1-20(2,3)22-29(26,27)17-7-4-15(5-8-17)19(25)24-12-10-23(11-13-24)14-16-6-9-18(21)28-16/h4-9,22H,10-14H2,1-3H3