[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl] 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid [(2R)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl] 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid [(1R)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C18H13Cl2NO3S MolecularWeight: 394.27172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)OC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2NO3S/c1-10(17(22)21-12-5-3-2-4-6-12)24-18(23)16-15(20)13-8-7-11(19)9-14(13)25-16/h2-10H,1H3,(H,21,22)/t10-/m1/s1