O4-(1,3-benzothiazol-2-ylsulfanyl) O1-butyl butanedioate

Systemtic Name: O4-(1,3-benzothiazol-2-ylsulfanyl) O1-butyl butanedioate Openeye Name: O4-(1,3-benzothiazol-2-ylsulfanyl) O1-butyl butanedioate CAS Name: butanedioic acid O4-(1,3-benzothiazol-2-ylthio) ester O1-butyl ester IUPAC Name: 4-O-(1,3-benzothiazol-2-ylsulfanyl) 1-O-butyl butanedioate Traditional Name: succinic acid O4-(1,3-benzothiazol-2-ylthio) ester O1-butyl ester Formula: C15H17NO4S2 MolecularWeight: 339.42978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCC(=O)OSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCCCOC(=O)CCC(=O)OSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H17NO4S2/c1-2-3-10-19-13(17)8-9-14(18)20-22-15-16-11-6-4-5-7-12(11)21-15/h4-7H,2-3,8-10H2,1H3