4-[2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methylamino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]amino]ethyl]benzenesulfonamide Formula: C21H23ClN2O4S2 MolecularWeight: 467.00132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCC2=CC=C(C=C2)S(=O)(=O)N)Cl)OCC3=CC=CS3

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCC2=CC=C(C=C2)S(=O)(=O)N)Cl)OCC3=CC=CS3

InChI

InChI=1S/C21H23ClN2O4S2/c1-27-20-12-16(11-19(22)21(20)28-14-17-3-2-10-29-17)13-24-9-8-15-4-6-18(7-5-15)30(23,25)26/h2-7,10-12,24H,8-9,13-14H2,1H3,(H2,23,25,26)