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butyl 6-chloranyl-2-sulfanylidene-1,3-benzoxazole-3-carboxylate

butyl 6-chloranyl-2-sulfanylidene-1,3-benzoxazole-3-carboxylate

Systemtic Name:butyl 6-chloranyl-2-sulfanylidene-1,3-benzoxazole-3-carboxylate
Openeye Name:butyl 6-chloro-2-thioxo-1,3-benzoxazole-3-carboxylate
CAS Name:6-chloro-2-sulfanylidene-1,3-benzoxazole-3-carboxylic acid butyl ester
IUPAC Name:butyl 6-chloro-2-sulfanylidene-1,3-benzoxazole-3-carboxylate
Traditional Name:6-chloro-2-thioxo-1,3-benzoxazole-3-carboxylic acid butyl ester
Formula: C12H12ClNO3S
MolecularWeight: 285.74658
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C2=C(C=C(C=C2)Cl)OC1=S


Isomeric SMILES

CCCCOC(=O)N1C2=C(C=C(C=C2)Cl)OC1=S


InChI

InChI=1S/C12H12ClNO3S/c1-2-3-6-16-11(15)14-9-5-4-8(13)7-10(9)17-12(14)18/h4-5,7H,2-3,6H2,1H3


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