methyl 5-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 5-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]thiophene-2-carboxylate CAS Name: 5-[[(2S,3S)-3-methyl-1-oxo-2-phenylpentyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[(2S,3S)-3-methyl-2-phenylpentanoyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)NC2=CC=C(S2)C(=O)OC

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC=CC=C1)C(=O)NC2=CC=C(S2)C(=O)OC

InChI

InChI=1S/C18H21NO3S/c1-4-12(2)16(13-8-6-5-7-9-13)17(20)19-15-11-10-14(23-15)18(21)22-3/h5-12,16H,4H2,1-3H3,(H,19,20)/t12-,16-/m0/s1