ethyl 4-(oxolan-2-ylmethylsulfanylcarbothioylamino)butanoate

Systemtic Name: ethyl 4-(oxolan-2-ylmethylsulfanylcarbothioylamino)butanoate Openeye Name: ethyl 4-(tetrahydrofuran-2-ylmethylsulfanylcarbothioylamino)butanoate CAS Name: 4-[[(2-oxolanylmethylthio)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-(oxolan-2-ylmethylsulfanylcarbothioylamino)butanoate Traditional Name: 4-[(tetrahydrofurfurylthio)carbothioylamino]butyric acid ethyl ester Formula: C12H21NO3S2 MolecularWeight: 291.43004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=S)SCC1CCCO1

Isomeric SMILES

CCOC(=O)CCCNC(=S)SCC1CCCO1

InChI

InChI=1S/C12H21NO3S2/c1-2-15-11(14)6-3-7-13-12(17)18-9-10-5-4-8-16-10/h10H,2-9H2,1H3,(H,13,17)