methyl 6-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-ylcarbothioylamino)hexanoate

Systemtic Name: methyl 6-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-ylcarbothioylamino)hexanoate Openeye Name: methyl 6-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbothioylamino)hexanoate CAS Name: 6-[[1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl(sulfanylidene)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbothioylamino)hexanoate Traditional Name: 6-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbothioylamino)hexanoic acid methyl ester Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=S)N1CCN2C1=NC3=CC=CC=C32

Isomeric SMILES

COC(=O)CCCCCNC(=S)N1CCN2C1=NC3=CC=CC=C32

InChI

InChI=1S/C17H22N4O2S/c1-23-15(22)9-3-2-6-10-18-17(24)21-12-11-20-14-8-5-4-7-13(14)19-16(20)21/h4-5,7-8H,2-3,6,9-12H2,1H3,(H,18,24)