1-(5-chloranyl-2-methyl-phenyl)-4-[1-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]butyl]piperazine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-[1-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]butyl]piperazine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-[1-[1-(2-thienylmethyl)tetrazol-5-yl]butyl]piperazine CAS Name: 1-(5-chloro-2-methylphenyl)-4-[1-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]butyl]piperazine IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-[1-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]butyl]piperazine Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-[1-[1-(2-thenyl)tetrazol-5-yl]butyl]piperazine Formula: C21H27ClN6S MolecularWeight: 430.99728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=NN1CC2=CC=CS2)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CCCC(C1=NN=NN1CC2=CC=CS2)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

InChI

InChI=1S/C21H27ClN6S/c1-3-5-19(21-23-24-25-28(21)15-18-6-4-13-29-18)26-9-11-27(12-10-26)20-14-17(22)8-7-16(20)2/h4,6-8,13-14,19H,3,5,9-12,15H2,1-2H3