N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]piazthiole-5-carboxamide Formula: C25H27N5OS2 MolecularWeight: 477.64478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC5=NSN=C5C=C4

Isomeric SMILES

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC5=NSN=C5C=C4

InChI

InChI=1S/C25H27N5OS2/c1-18(26-25(31)20-9-10-21-22(16-20)28-33-27-21)24(23-8-5-15-32-23)30-13-11-29(12-14-30)17-19-6-3-2-4-7-19/h2-10,15-16,18,24H,11-14,17H2,1H3,(H,26,31)