4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-(p-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-(p-tolyl)-1H-1,2,4-triazole-5-thione Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2/N=C\C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H16N4O2S/c1-12-2-5-14(6-3-12)17-20-21-18(25)22(17)19-11-13-4-7-15-16(10-13)24-9-8-23-15/h2-7,10-11H,8-9H2,1H3,(H,21,25)/b19-11-