methyl 2-[6-(3-azanylpropoxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[6-(3-azanylpropoxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[6-(3-aminopropoxy)-1,3-benzothiazol-2-yl]-4,5-dihydrothiazole-4-carboxylate CAS Name: 2-[6-(3-aminopropoxy)-1,3-benzothiazol-2-yl]-4,5-dihydrothiazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[6-(3-aminopropoxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylate Traditional Name: 2-[6-(3-aminopropoxy)-1,3-benzothiazol-2-yl]-2-thiazoline-4-carboxylic acid methyl ester Formula: C15H17N3O3S2 MolecularWeight: 351.44378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(=N1)C2=NC3=C(S2)C=C(C=C3)OCCCN

Isomeric SMILES

COC(=O)C1CSC(=N1)C2=NC3=C(S2)C=C(C=C3)OCCCN

InChI

InChI=1S/C15H17N3O3S2/c1-20-15(19)11-8-22-13(18-11)14-17-10-4-3-9(7-12(10)23-14)21-6-2-5-16/h3-4,7,11H,2,5-6,8,16H2,1H3