2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[4-(1-naphthylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 2-[[4-(1-naphthalenylmethyl)-1-piperazinyl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[4-(1-naphthylmethyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C21H25N5S MolecularWeight: 379.5217

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN(C1=S)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C=CCN1C=NN(C1=S)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H25N5S/c1-2-10-25-16-22-26(21(25)27)17-24-13-11-23(12-14-24)15-19-8-5-7-18-6-3-4-9-20(18)19/h2-9,16H,1,10-15,17H2