4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-N-ethyl-butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethylbutanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethylbutanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-N-ethyl-butyramide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H26N4O4S/c1-2-27(15-21(28)24-16-9-10-19-20(14-16)31-12-11-30-19)22(29)8-5-13-32-23-25-17-6-3-4-7-18(17)26-23/h3-4,6-7,9-10,14H,2,5,8,11-13,15H2,1H3,(H,24,28)(H,25,26)