2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-[(5-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[1-(2,4-dimethoxybenzyl)-3-keto-piperazin-2-yl]-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(S1)CNC(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O4S/c1-14-4-7-17(29-14)12-23-20(25)11-18-21(26)22-8-9-24(18)13-15-5-6-16(27-2)10-19(15)28-3/h4-7,10,18H,8-9,11-13H2,1-3H3,(H,22,26)(H,23,25)