2-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(5-chloro-2-thienyl)methylcarbamoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[[(5-chloro-2-thiophenyl)methylamino]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(5-chlorothiophen-2-yl)methylcarbamoylamino]-4-methylpentanoic acid Traditional Name: 2-[(5-chloro-2-thienyl)methylcarbamoylamino]-4-methyl-valeric acid Formula: C12H17ClN2O3S MolecularWeight: 304.79298

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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)CC(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)