5-morpholin-4-yl-4-phenyl-2-[[(phenylmethyl)-propyl-amino]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-morpholin-4-yl-4-phenyl-2-[[(phenylmethyl)-propyl-amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 2-[[benzyl(propyl)amino]methyl]-5-morpholino-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-(4-morpholinyl)-4-phenyl-2-[[(phenylmethyl)-propylamino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 2-[[benzyl(propyl)amino]methyl]-5-morpholin-4-yl-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[benzyl(propyl)amino]methyl]-5-morpholino-4-phenyl-1,2,4-triazole-3-thione Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CCCN(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5OS/c1-2-13-25(18-20-9-5-3-6-10-20)19-27-23(30)28(21-11-7-4-8-12-21)22(24-27)26-14-16-29-17-15-26/h3-12H,2,13-19H2,1H3