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

Systemtic Name: O4-(1,3-benzothiazol-2-ylsulfanyl) O1-butyl butanedioate; diethylazanium Openeye Name: O4-(1,3-benzothiazol-2-ylsulfanyl) O1-butyl butanedioate; diethylammonium CAS Name: butanedioic acid O4-(1,3-benzothiazol-2-ylthio) ester O1-butyl ester; diethylammonium IUPAC Name: 4-O-(1,3-benzothiazol-2-ylsulfanyl) 1-O-butyl butanedioate; diethylazanium Traditional Name: diethylammonium; succinic acid O4-(1,3-benzothiazol-2-ylthio) ester O1-butyl ester Formula: C19H29N2O4S2+ MolecularWeight: 413.57456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCC(=O)OSC1=NC2=CC=CC=C2S1.CC[NH2+]CC

Isomeric SMILES

CCCCOC(=O)CCC(=O)OSC1=NC2=CC=CC=C2S1.CC[NH2+]CC

InChI

InChI=1S/C15H17NO4S2.C4H11N/c1-2-3-10-19-13(17)8-9-14(18)20-22-15-16-11-6-4-5-7-12(11)21-15;1-3-5-4-2/h4-7H,2-3,8-10H2,1H3;5H,3-4H2,1-2H3/p+1