(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-thiophen-3-yl-1,3-thiazole-4-carboxylate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-(3-thienyl)thiazole-4-carboxylate CAS Name: 2-(3-thiophenyl)-4-thiazolecarboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-thienyl)thiazole-4-carboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H12ClNO4S2 MolecularWeight: 393.86448

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C17H12ClNO4S2/c18-12-5-10(6-14-15(12)22-3-2-21-14)7-23-17(20)13-9-25-16(19-13)11-1-4-24-8-11/h1,4-6,8-9H,2-3,7H2