1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-(5-methylthiophen-2-yl)butane-1,4-dione

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-(5-methylthiophen-2-yl)butane-1,4-dione Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-(5-methyl-2-thienyl)butane-1,4-dione CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-(5-methyl-2-thiophenyl)butane-1,4-dione IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-(5-methylthiophen-2-yl)butane-1,4-dione Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-4-(5-methyl-2-thienyl)butane-1,4-dione Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(S3)C

InChI

InChI=1S/C20H23ClN2O2S/c1-14-3-5-16(21)13-17(14)22-9-11-23(12-10-22)20(25)8-6-18(24)19-7-4-15(2)26-19/h3-5,7,13H,6,8-12H2,1-2H3