2-(morpholin-4-ylmethyl)-4-phenyl-5-[(4-propoxyphenyl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-[(4-propoxyphenyl)methyl]-1,2,4-triazole-3-thione Openeye Name: 2-(morpholinomethyl)-4-phenyl-5-[(4-propoxyphenyl)methyl]-1,2,4-triazole-3-thione CAS Name: 2-(4-morpholinylmethyl)-4-phenyl-5-[(4-propoxyphenyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-[(4-propoxyphenyl)methyl]-1,2,4-triazole-3-thione Traditional Name: 2-(morpholinomethyl)-4-phenyl-5-(4-propoxybenzyl)-1,2,4-triazole-3-thione Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC2=NN(C(=S)N2C3=CC=CC=C3)CN4CCOCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC2=NN(C(=S)N2C3=CC=CC=C3)CN4CCOCC4

InChI

InChI=1S/C23H28N4O2S/c1-2-14-29-21-10-8-19(9-11-21)17-22-24-26(18-25-12-15-28-16-13-25)23(30)27(22)20-6-4-3-5-7-20/h3-11H,2,12-18H2,1H3