[aminocarbonyl-[1-(1-benzothiophen-2-yl)ethyl]amino] 3-sulfanylidenepropanoate

Systemtic Name: [aminocarbonyl-[1-(1-benzothiophen-2-yl)ethyl]amino] 3-sulfanylidenepropanoate Openeye Name: [1-(benzothiophen-2-yl)ethyl-carbamoyl-amino] 3-thioxopropanoate CAS Name: 3-sulfanylidenepropanoic acid [1-(1-benzothiophen-2-yl)ethyl-carbamoylamino] ester IUPAC Name: [1-(1-benzothiophen-2-yl)ethyl-carbamoylamino] 3-sulfanylidenepropanoate Traditional Name: 3-thioxopropionic acid [1-(benzothiophen-2-yl)ethyl-carbamoyl-amino] ester Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)OC(=O)CC=S

Isomeric SMILES

CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)OC(=O)CC=S

InChI

InChI=1S/C14H14N2O3S2/c1-9(16(14(15)18)19-13(17)6-7-20)12-8-10-4-2-3-5-11(10)21-12/h2-5,7-9H,6H2,1H3,(H2,15,18)