4-[[4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[4-(2-chlorobenzyl)oxy-3-ethoxy-benzyl]amino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C23H22ClN5O2S MolecularWeight: 467.97108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNN2C(=NNC2=S)C3=CC=NC=C3)OCC4=CC=CC=C4Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNN2C(=NNC2=S)C3=CC=NC=C3)OCC4=CC=CC=C4Cl

InChI

InChI=1S/C23H22ClN5O2S/c1-2-30-21-13-16(7-8-20(21)31-15-18-5-3-4-6-19(18)24)14-26-29-22(27-28-23(29)32)17-9-11-25-12-10-17/h3-13,26H,2,14-15H2,1H3,(H,28,32)