N-[(2S)-1-[4-(ethylcarbamothioyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-[4-(ethylcarbamothioyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]ethanamide Openeye Name: N-[(1S)-1-benzyl-2-[4-(ethylcarbamothioyl)piperazin-1-yl]-2-oxo-ethyl]acetamide CAS Name: N-[(2S)-1-[4-[ethylamino(sulfanylidene)methyl]-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]acetamide IUPAC Name: N-[(2S)-1-[4-(ethylcarbamothioyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]acetamide Traditional Name: N-[(1S)-1-benzyl-2-[4-(ethylthiocarbamoyl)piperazino]-2-keto-ethyl]acetamide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CCNC(=S)N1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C18H26N4O2S/c1-3-19-18(25)22-11-9-21(10-12-22)17(24)16(20-14(2)23)13-15-7-5-4-6-8-15/h4-8,16H,3,9-13H2,1-2H3,(H,19,25)(H,20,23)/t16-/m0/s1