4-(indol-3-ylidenemethylamino)-3-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(indol-3-ylidenemethylamino)-3-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(indol-3-ylidenemethylamino)-3-[(2-isopropyl-5-methyl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-indolylidenemethylamino)-3-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(indol-3-ylidenemethylamino)-3-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(indol-3-ylidenemethylamino)-3-[(2-isopropyl-5-methyl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NNC(=S)N2NC=C3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NNC(=S)N2NC=C3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H23N5OS/c1-14(2)17-9-8-15(3)10-20(17)28-13-21-25-26-22(29)27(21)24-12-16-11-23-19-7-5-4-6-18(16)19/h4-12,14,24H,13H2,1-3H3,(H,26,29)