N-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[[5-(1H-benzimidazol-2-yl)-2-methylphenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC(=S)NC(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC(=S)NC(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H20N4O3S/c1-14-6-7-15(22-25-17-4-2-3-5-18(17)26-22)12-19(14)27-24(32)28-23(29)16-8-9-20-21(13-16)31-11-10-30-20/h2-9,12-13H,10-11H2,1H3,(H,25,26)(H2,27,28,29,32)