1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride

Systemtic Name: 1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride Openeye Name: 1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-thiazol-5-yl]ethanone hydrochloride CAS Name: 1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-5-thiazolyl]ethanone hydrochloride IUPAC Name: 1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride Traditional Name: 1-[2-(1,3-benzodioxol-5-ylamino)-4-methyl-thiazol-5-yl]ethanone hydrochloride Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC3=C(C=C2)OCO3)C(=O)C.Cl

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC3=C(C=C2)OCO3)C(=O)C.Cl

InChI

InChI=1S/C13H12N2O3S.ClH/c1-7-12(8(2)16)19-13(14-7)15-9-3-4-10-11(5-9)18-6-17-10;/h3-5H,6H2,1-2H3,(H,14,15);1H