1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]methyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[[4-(3-methylbenzyl)piperazino]methyl]-4-(2-thienyl)tetrazol-5-one Formula: C18H22N6OS MolecularWeight: 370.47188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C18H22N6OS/c1-15-4-2-5-16(12-15)13-21-7-9-22(10-8-21)14-23-18(25)24(20-19-23)17-6-3-11-26-17/h2-6,11-12H,7-10,13-14H2,1H3