N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]-4-propoxy-benzenesulfonamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]-4-propoxy-benzenesulfonamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]-4-propoxy-benzenesulfonamide CAS Name: N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]-4-propoxybenzenesulfonamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]-4-propoxybenzenesulfonamide Traditional Name: N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]-4-propoxy-benzenesulfonamide Formula: C20H29N3O3S2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

InChI

InChI=1S/C20H29N3O3S2/c1-3-13-26-18-4-6-19(7-5-18)28(24,25)21-15-20(17-8-14-27-16-17)23-11-9-22(2)10-12-23/h4-8,14,16,20-21H,3,9-13,15H2,1-2H3