1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine

Systemtic Name: 1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine Openeye Name: 1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(2-thienylmethyl)tetrazol-5-yl]methyl]piperazine CAS Name: 1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]piperazine IUPAC Name: 1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]methyl]piperazine Traditional Name: 1-(2,3-dimethylphenyl)-4-[(2-fluorophenyl)-[1-(2-thenyl)tetrazol-5-yl]methyl]piperazine Formula: C25H27FN6S MolecularWeight: 462.585483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=CC=C3F)C4=NN=NN4CC5=CC=CS5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=CC=C3F)C4=NN=NN4CC5=CC=CS5)C

InChI

InChI=1S/C25H27FN6S/c1-18-7-5-11-23(19(18)2)30-12-14-31(15-13-30)24(21-9-3-4-10-22(21)26)25-27-28-29-32(25)17-20-8-6-16-33-20/h3-11,16,24H,12-15,17H2,1-2H3