4-(4-ethoxyphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-(4-ethoxyphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-(4-ethoxyphenyl)-2-(morpholinomethyl)-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-(4-ethoxyphenyl)-2-(4-morpholinylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-(4-ethoxyphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-(morpholinomethyl)-4-p-phenetyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCOCC3)C4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCOCC3)C4=CC=NC=C4

InChI

InChI=1S/C20H23N5O2S/c1-2-27-18-5-3-17(4-6-18)25-19(16-7-9-21-10-8-16)22-24(20(25)28)15-23-11-13-26-14-12-23/h3-10H,2,11-15H2,1H3