methyl (2S)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylcarbamoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylcarbamoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[(3-chlorobenzothiophene-2-carbonyl)carbamoylamino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamoylamino]-3-hydroxypropanoate Traditional Name: (2S)-2-[(3-chlorobenzothiophene-2-carbonyl)carbamoylamino]-3-hydroxy-propionic acid methyl ester Formula: C14H13ClN2O5S MolecularWeight: 356.78142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O5S/c1-22-13(20)8(6-18)16-14(21)17-12(19)11-10(15)7-4-2-3-5-9(7)23-11/h2-5,8,18H,6H2,1H3,(H2,16,17,19,21)/t8-/m0/s1