methyl 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(1,1-dioxothian-4-yl)amino]-3-(2-thienyl)propanoate CAS Name: 3-[(1,1-dioxo-4-thianyl)amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(1,1-dioxothian-4-yl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(1,1-diketothian-4-yl)amino]-3-(2-thienyl)propionic acid methyl ester Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC2CCS(=O)(=O)CC2

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC2CCS(=O)(=O)CC2

InChI

InChI=1S/C13H19NO4S2/c1-18-13(15)9-11(12-3-2-6-19-12)14-10-4-7-20(16,17)8-5-10/h2-3,6,10-11,14H,4-5,7-9H2,1H3