N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(2-thienylmethyl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-2-benzimidazolyl)thio]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methylbenzimidazol-2-yl)thio]-N-(2-thenyl)acetamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)N(CC3=CC=CS3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)N(CC3=CC=CS3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H21N3O3S2/c1-25-19-7-3-2-6-18(19)24-23(25)31-15-22(27)26(14-17-5-4-12-30-17)16-8-9-20-21(13-16)29-11-10-28-20/h2-9,12-13H,10-11,14-15H2,1H3