3-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-4-propoxy-benzenesulfonamide

Systemtic Name: 3-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-4-propoxy-benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-3-methyl-4-propoxy-benzenesulfonamide CAS Name: 3-methyl-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-4-propoxybenzenesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-3-methyl-4-propoxybenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-3-methyl-4-propoxy-benzenesulfonamide Formula: C28H37N3O3S2 MolecularWeight: 527.74168

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)NC(C)C(C2=CC=CS2)N3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)NC(C)C(C2=CC=CS2)N3CCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H37N3O3S2/c1-4-18-34-26-13-12-25(20-22(26)2)36(32,33)29-23(3)28(27-11-8-19-35-27)31-16-14-30(15-17-31)21-24-9-6-5-7-10-24/h5-13,19-20,23,28-29H,4,14-18,21H2,1-3H3