ethyl 2-[4-[(4-methoxyphenyl)methylcarbamothioyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-methoxyphenyl)methylcarbamothioyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(4-methoxyphenyl)methylcarbamothioyl]piperazin-1-yl]acetate CAS Name: 2-[4-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-methoxyphenyl)methylcarbamothioyl]piperazin-1-yl]acetate Traditional Name: 2-[4-(p-anisylthiocarbamoyl)piperazino]acetic acid ethyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)C(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)C(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N3O3S/c1-3-23-16(21)13-19-8-10-20(11-9-19)17(24)18-12-14-4-6-15(22-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H,18,24)