N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-yl]propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propanamide Traditional Name: 2-[4-(2-thienylsulfonyl)piperazino]-N-veratryl-propionamide Formula: C20H27N3O5S2 MolecularWeight: 453.57548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H27N3O5S2/c1-15(20(24)21-14-16-6-7-17(27-2)18(13-16)28-3)22-8-10-23(11-9-22)30(25,26)19-5-4-12-29-19/h4-7,12-13,15H,8-11,14H2,1-3H3,(H,21,24)