4-[(2-methylindol-3-ylidene)methylamino]-3-[(4-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(2-methylindol-3-ylidene)methylamino]-3-[(4-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-isopropylphenoxy)methyl]-4-[(2-methylindol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2-methyl-3-indolylidene)methylamino]-3-[(4-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(2-methylindol-3-ylidene)methylamino]-3-[(4-propan-2-ylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-isopropylphenoxy)methyl]-4-[(2-methylindol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C1=CNN3C(=NNC3=S)COC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C1=CNN3C(=NNC3=S)COC4=CC=C(C=C4)C(C)C

InChI

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