methyl 4-methyl-5-(phenylmethyl)-2-(propanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-(phenylmethyl)-2-(propanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-benzyl-4-methyl-2-(propanoylamino)thiophene-3-carboxylate CAS Name: 4-methyl-2-(1-oxopropylamino)-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-4-methyl-2-(propanoylamino)thiophene-3-carboxylate Traditional Name: 5-benzyl-4-methyl-2-propionamido-thiophene-3-carboxylic acid methyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(S1)CC2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C(=C(S1)CC2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C17H19NO3S/c1-4-14(19)18-16-15(17(20)21-3)11(2)13(22-16)10-12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3,(H,18,19)