4-[(E)-(3-methoxy-2-phenylmethoxy-phenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(3-methoxy-2-phenylmethoxy-phenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(2-benzyloxy-3-methoxy-phenyl)methyleneamino]-3-isopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-methoxy-2-phenylmethoxyphenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-methoxy-2-phenylmethoxyphenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(2-benzoxy-3-methoxy-benzylidene)amino]-3-isopropyl-1H-1,2,4-triazole-5-thione Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=S)N1N=CC2=C(C(=CC=C2)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NNC(=S)N1/N=C/C2=C(C(=CC=C2)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-14(2)19-22-23-20(27)24(19)21-12-16-10-7-11-17(25-3)18(16)26-13-15-8-5-4-6-9-15/h4-12,14H,13H2,1-3H3,(H,23,27)/b21-12+