(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C17H13NO4S2 MolecularWeight: 359.41942

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C17H13NO4S2/c19-17(15-8-20-13-3-1-2-4-14(13)22-15)21-7-12-10-24-16(18-12)11-5-6-23-9-11/h1-6,9-10,15H,7-8H2/t15-/m0/s1