methyl 4-[(5-oxidanylidene-1-propyl-2H-pyrrol-3-yl)amino]-5-pentyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-[(5-oxidanylidene-1-propyl-2H-pyrrol-3-yl)amino]-5-pentyl-thiophene-3-carboxylate Openeye Name: methyl 4-[(5-oxo-1-propyl-2H-pyrrol-3-yl)amino]-5-pentyl-thiophene-3-carboxylate CAS Name: 4-[(5-oxo-1-propyl-2H-pyrrol-3-yl)amino]-5-pentyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[(5-oxo-1-propyl-2H-pyrrol-3-yl)amino]-5-pentylthiophene-3-carboxylate Traditional Name: 5-amyl-4-[(5-keto-1-propyl-3-pyrrolin-3-yl)amino]thiophene-3-carboxylic acid methyl ester Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=CS1)C(=O)OC)NC2=CC(=O)N(C2)CCC

Isomeric SMILES

CCCCCC1=C(C(=CS1)C(=O)OC)NC2=CC(=O)N(C2)CCC

InChI

InChI=1S/C18H26N2O3S/c1-4-6-7-8-15-17(14(12-24-15)18(22)23-3)19-13-10-16(21)20(11-13)9-5-2/h10,12,19H,4-9,11H2,1-3H3