2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N,N-diethyl-2-phenyl-ethanamide; ethanedioic acid

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N,N-diethyl-2-phenyl-ethanamide; ethanedioic acid Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N,N-diethyl-2-phenyl-acetamide; oxalic acid CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-N,N-diethyl-2-phenylacetamide; oxalic acid IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N,N-diethyl-2-phenylacetamide; oxalic acid Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-N,N-diethyl-2-phenyl-acetamide; oxalic acid Formula: C28H34N4O9S MolecularWeight: 602.65596

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)N2CCN(CC2)CC3=NC4=CC=CC=C4S3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)N2CCN(CC2)CC3=NC4=CC=CC=C4S3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H30N4OS.2C2H2O4/c1-3-27(4-2)24(29)23(19-10-6-5-7-11-19)28-16-14-26(15-17-28)18-22-25-20-12-8-9-13-21(20)30-22;2*3-1(4)2(5)6/h5-13,23H,3-4,14-18H2,1-2H3;2*(H,3,4)(H,5,6)