2-(3-methyl-4-propan-2-yl-phenoxy)-1-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-methyl-4-propan-2-yl-phenoxy)-1-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethanone CAS Name: 2-(3-methyl-4-propan-2-ylphenoxy)-1-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-methyl-4-propan-2-ylphenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazino]ethanone Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C23H28N6O2/c1-17(2)21-10-9-20(15-18(21)3)31-16-22(30)27-11-13-28(14-12-27)23-24-25-26-29(23)19-7-5-4-6-8-19/h4-10,15,17H,11-14,16H2,1-3H3