methyl 4-(butylamino)-4-sulfanylidene-butanoate

Systemtic Name: methyl 4-(butylamino)-4-sulfanylidene-butanoate Openeye Name: methyl 4-(butylamino)-4-thioxo-butanoate CAS Name: 4-(butylamino)-4-sulfanylidenebutanoic acid methyl ester IUPAC Name: methyl 4-(butylamino)-4-sulfanylidenebutanoate Traditional Name: 4-(butylamino)-4-thioxo-butyric acid methyl ester Formula: C9H17NO2S MolecularWeight: 203.30178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)CCC(=O)OC

Isomeric SMILES

CCCCNC(=S)CCC(=O)OC

InChI

InChI=1S/C9H17NO2S/c1-3-4-7-10-8(13)5-6-9(11)12-2/h3-7H2,1-2H3,(H,10,13)