1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-thiophen-2-yl-methyl]-4-(2-methoxyphenyl)piperazine

Systemtic Name: 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-thiophen-2-yl-methyl]-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[(1-tert-butyltetrazol-5-yl)-(2-thienyl)methyl]-4-(2-methoxyphenyl)piperazine CAS Name: 1-[(1-tert-butyl-5-tetrazolyl)-thiophen-2-ylmethyl]-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-[(1-tert-butyltetrazol-5-yl)-thiophen-2-ylmethyl]-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[(1-tert-butyltetrazol-5-yl)-(2-thienyl)methyl]-4-(2-methoxyphenyl)piperazine Formula: C21H28N6OS MolecularWeight: 412.55162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C(C2=CC=CS2)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)C(C2=CC=CS2)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C21H28N6OS/c1-21(2,3)27-20(22-23-24-27)19(18-10-7-15-29-18)26-13-11-25(12-14-26)16-8-5-6-9-17(16)28-4/h5-10,15,19H,11-14H2,1-4H3