2-chloroethyl 2-[[2-(carbamothioylhydrazinylidene)-1,3-benzothiazol-3-yl]methylsulfanyl]ethanoate

Systemtic Name: 2-chloroethyl 2-[[2-(carbamothioylhydrazinylidene)-1,3-benzothiazol-3-yl]methylsulfanyl]ethanoate Openeye Name: 2-chloroethyl 2-[[2-(carbamothioylhydrazono)-1,3-benzothiazol-3-yl]methylsulfanyl]acetate CAS Name: 2-[[2-(carbamothioylhydrazinylidene)-1,3-benzothiazol-3-yl]methylthio]acetic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 2-[[2-(carbamothioylhydrazinylidene)-1,3-benzothiazol-3-yl]methylsulfanyl]acetate Traditional Name: 2-[[2-(thiocarbamoylhydrazono)-1,3-benzothiazol-3-yl]methylthio]acetic acid 2-chloroethyl ester Formula: C13H15ClN4O2S3 MolecularWeight: 390.9318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=NNC(=S)N)S2)CSCC(=O)OCCCl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=NNC(=S)N)S2)CSCC(=O)OCCCl

InChI

InChI=1S/C13H15ClN4O2S3/c14-5-6-20-11(19)7-22-8-18-9-3-1-2-4-10(9)23-13(18)17-16-12(15)21/h1-4H,5-8H2,(H3,15,16,21)