[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C16H17ClN2O4S/c1-3-9(2)18-16(22)19-12(20)8-23-15(21)14-13(17)10-6-4-5-7-11(10)24-14/h4-7,9H,3,8H2,1-2H3,(H2,18,19,20,22)/t9-/m1/s1