methyl 5-(2-azanyl-2-oxidanylidene-ethyl)-4-(5-cyanopentylcarbamoyloxy)-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-(2-azanyl-2-oxidanylidene-ethyl)-4-(5-cyanopentylcarbamoyloxy)-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-(2-amino-2-oxo-ethyl)-4-(5-cyanopentylcarbamoyloxy)-3-methyl-thiophene-2-carboxylate CAS Name: 5-(2-amino-2-oxoethyl)-4-[(5-cyanopentylamino)-oxomethoxy]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-amino-2-oxoethyl)-4-(5-cyanopentylcarbamoyloxy)-3-methylthiophene-2-carboxylate Traditional Name: 5-(2-amino-2-keto-ethyl)-4-(5-cyanopentylcarbamoyloxy)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1OC(=O)NCCCCCC#N)CC(=O)N)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1OC(=O)NCCCCCC#N)CC(=O)N)C(=O)OC

InChI

InChI=1S/C16H21N3O5S/c1-10-13(24-16(22)19-8-6-4-3-5-7-17)11(9-12(18)20)25-14(10)15(21)23-2/h3-6,8-9H2,1-2H3,(H2,18,20)(H,19,22)