4-(2-azanylethyl)-3-(8-nitro-3,4-dihydro-2H-chromen-3-yl)-1H-imidazole-2-thione hydrochloride

Systemtic Name: 4-(2-azanylethyl)-3-(8-nitro-3,4-dihydro-2H-chromen-3-yl)-1H-imidazole-2-thione hydrochloride Openeye Name: 4-(2-aminoethyl)-3-(8-nitrochroman-3-yl)-1H-imidazole-2-thione hydrochloride CAS Name: 4-(2-aminoethyl)-3-(8-nitro-3,4-dihydro-2H-1-benzopyran-3-yl)-1H-imidazole-2-thione hydrochloride IUPAC Name: 4-(2-aminoethyl)-3-(8-nitro-3,4-dihydro-2H-chromen-3-yl)-1H-imidazole-2-thione hydrochloride Traditional Name: 5-(2-aminoethyl)-1-(8-nitrochroman-3-yl)-4-imidazoline-2-thione hydrochloride Formula: C14H17ClN4O3S MolecularWeight: 356.82778

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=CC=C2[N+](=O)[O-])N3C(=CNC3=S)CCN.Cl

Isomeric SMILES

C1C(COC2=C1C=CC=C2[N+](=O)[O-])N3C(=CNC3=S)CCN.Cl

InChI

InChI=1S/C14H16N4O3S.ClH/c15-5-4-10-7-16-14(22)17(10)11-6-9-2-1-3-12(18(19)20)13(9)21-8-11;/h1-3,7,11H,4-6,8,15H2,(H,16,22);1H