ethyl 4-[(4-phenoxyphenyl)carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-phenoxyphenyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-phenoxyphenyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[(4-phenoxyanilino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-phenoxyphenyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(4-phenoxyphenyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3S/c1-2-25-20(24)23-14-12-22(13-15-23)19(27)21-16-8-10-18(11-9-16)26-17-6-4-3-5-7-17/h3-11H,2,12-15H2,1H3,(H,21,27)