ethyl 2-azanyl-4-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-amino-4-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-amino-5-(methylcarbamoyl)-4-[[(2E,4E)-1-oxohexa-2,4-dienoxy]methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-amino-4-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C=CC=CC)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)/C=C/C=C/C)C(=O)NC)N

InChI

InChI=1S/C16H20N2O5S/c1-4-6-7-8-11(19)23-9-10-12(16(21)22-5-2)14(17)24-13(10)15(20)18-3/h4,6-8H,5,9,17H2,1-3H3,(H,18,20)/b6-4+,8-7+