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

Systemtic Name: methyl 5-[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 5-[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]thiophene-2-carboxylate CAS Name: 5-[[(2S,3S)-2-benzamido-3-methyl-1-oxopentyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[(2S,3S)-2-benzamido-3-methylpentanoyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(S1)C(=O)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=CC=C(S1)C(=O)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O4S/c1-4-12(2)16(21-17(22)13-8-6-5-7-9-13)18(23)20-15-11-10-14(26-15)19(24)25-3/h5-12,16H,4H2,1-3H3,(H,20,23)(H,21,22)/t12-,16-/m0/s1