ethyl 4-[2-(3-aminophenyl)sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-aminophenyl)sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-aminophenyl)sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(3-aminophenyl)thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-aminophenyl)sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(3-aminophenyl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=CC=CC(=C2)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=CC=CC(=C2)N

InChI

InChI=1S/C15H21N3O3S/c1-2-21-15(20)18-8-6-17(7-9-18)14(19)11-22-13-5-3-4-12(16)10-13/h3-5,10H,2,6-9,11,16H2,1H3