1-(4-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazine; ethanedioic acid

Systemtic Name: 1-(4-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazine; ethanedioic acid Openeye Name: 1-(4-chlorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazine; oxalic acid CAS Name: 1-(4-chlorophenyl)-4-[(3-methyl-2-thiophenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-(4-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazine; oxalic acid Traditional Name: 1-(4-chlorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazine; oxalic acid Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCN(CC2)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(SC=C1)CN2CCN(CC2)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19ClN2S.C2H2O4/c1-13-6-11-20-16(13)12-18-7-9-19(10-8-18)15-4-2-14(17)3-5-15;3-1(4)2(5)6/h2-6,11H,7-10,12H2,1H3;(H,3,4)(H,5,6)