2-[4-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[4-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazin-1-yl]-1,3-benzothiazole Openeye Name: 2-[4-[(4-methoxyphenyl)-[1-(2-thienylmethyl)tetrazol-5-yl]methyl]piperazin-1-yl]-1,3-benzothiazole CAS Name: 2-[4-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 2-[4-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]methyl]piperazin-1-yl]-1,3-benzothiazole Traditional Name: 2-[4-[(4-methoxyphenyl)-[1-(2-thenyl)tetrazol-5-yl]methyl]piperazino]-1,3-benzothiazole Formula: C25H25N7OS2 MolecularWeight: 503.6423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=NN=NN2CC3=CC=CS3)N4CCN(CC4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=NN=NN2CC3=CC=CS3)N4CCN(CC4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H25N7OS2/c1-33-19-10-8-18(9-11-19)23(24-27-28-29-32(24)17-20-5-4-16-34-20)30-12-14-31(15-13-30)25-26-21-6-2-3-7-22(21)35-25/h2-11,16,23H,12-15,17H2,1H3