[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-azanyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 2-azanyl-5-methyl-thiophene-3-carboxylate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-amino-5-methyl-thiophene-3-carboxylate CAS Name: 2-amino-5-methyl-3-thiophenecarboxylic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-amino-5-methylthiophene-3-carboxylate Traditional Name: 2-amino-5-methyl-thiophene-3-carboxylic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)N)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)N)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S/c1-13-11-15(17(19)25-13)18(23)24-12-16(22)21-9-7-20(8-10-21)14-5-3-2-4-6-14/h2-6,11H,7-10,12,19H2,1H3