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

Systemtic Name: 2-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-4-isopropyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-4-propan-2-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-benzhydrylpiperazino)methyl]-4-isopropyl-1,2,4-triazole-3-thione Formula: C23H29N5S MolecularWeight: 407.57486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1C=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5S/c1-19(2)27-17-24-28(23(27)29)18-25-13-15-26(16-14-25)22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,17,19,22H,13-16,18H2,1-2H3