1-(2,5-dimethylthiophen-3-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(2,5-dimethyl-3-thienyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-4-[4-(4-methoxyphenyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(2,5-dimethyl-3-thienyl)-4-[4-(4-methoxyphenyl)piperazino]butane-1,4-dione Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O3S/c1-15-14-19(16(2)27-15)20(24)8-9-21(25)23-12-10-22(11-13-23)17-4-6-18(26-3)7-5-17/h4-7,14H,8-13H2,1-3H3