(2S)-2-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(5-chloro-2-thienyl)methylcarbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[(5-chloro-2-thiophenyl)methylamino]-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(5-chlorothiophen-2-yl)methylcarbamoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(5-chloro-2-thienyl)methylcarbamoylamino]-4-methyl-valerate Formula: C12H16ClN2O3S- MolecularWeight: 303.78504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NCC1=CC=C(S1)Cl

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NCC1=CC=C(S1)Cl

InChI

InChI=1S/C12H17ClN2O3S/c1-7(2)5-9(11(16)17)15-12(18)14-6-8-3-4-10(13)19-8/h3-4,7,9H,5-6H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1/t9-/m0/s1