2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 2-[(4-methyl-1-piperidyl)methyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 2-[(4-methyl-1-piperidinyl)methyl]-4-phenyl-5-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 2-[(4-methylpiperidino)methyl]-4-phenyl-5-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C20H29N5S MolecularWeight: 371.54276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CN2C(=S)N(C(=N2)CN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)CN2C(=S)N(C(=N2)CN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C20H29N5S/c1-17-9-13-23(14-10-17)16-24-20(26)25(18-7-3-2-4-8-18)19(21-24)15-22-11-5-6-12-22/h2-4,7-8,17H,5-6,9-16H2,1H3