4-cyclopropyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-5-propan-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-5-propan-2-yl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-5-propan-2-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-benzylpiperazino)methyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole-3-thione Formula: C20H29N5S MolecularWeight: 371.54276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=S)N1C2CC2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NN(C(=S)N1C2CC2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H29N5S/c1-16(2)19-21-24(20(26)25(19)18-8-9-18)15-23-12-10-22(11-13-23)14-17-6-4-3-5-7-17/h3-7,16,18H,8-15H2,1-2H3