1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-(1-phenyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(4-phenyl-1-piperazinyl)-2-[(1-phenyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-(1-phenyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(4-phenylpiperazino)-2-[(1-phenyltetrazol-5-yl)thio]propan-1-one Formula: C20H22N6OS MolecularWeight: 394.49328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H22N6OS/c1-16(28-20-21-22-23-26(20)18-10-6-3-7-11-18)19(27)25-14-12-24(13-15-25)17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3