[2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate Openeye Name: [2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxo-ethyl] 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]amino]-2-oxoethyl] 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [2-[[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-keto-ethyl] ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=C(C(=C(N2CCCOC)C)C)C#N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=C(C(=C(N2CCCOC)C)C)C#N

InChI

InChI=1S/C20H25N3O4S/c1-12-9-16(15(4)28-12)20(25)27-11-18(24)22-19-17(10-21)13(2)14(3)23(19)7-6-8-26-5/h9H,6-8,11H2,1-5H3,(H,22,24)