[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxidanylidene-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: [2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxidanylidene-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: [2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxo-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid [2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl] 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid [2-keto-2-[methyl-[(1S)-1-phenylethyl]amino]ethyl] ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)COC(=O)C2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(C)C(=O)COC(=O)C2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-15(16-8-4-3-5-9-16)21(2)18(23)14-25-20(24)19-17(10-13-26-19)22-11-6-7-12-22/h3-13,15H,14H2,1-2H3/t15-/m0/s1