methyl 4-[[(4R)-4-ethyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]carbamothioylamino]butanoate

Systemtic Name: methyl 4-[[(4R)-4-ethyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]carbamothioylamino]butanoate Openeye Name: methyl 4-[[(4R)-4-ethyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]carbamothioylamino]butanoate CAS Name: 4-[[[[(4R)-4-ethyl-2,5-dioxo-4-phenyl-1-imidazolidinyl]amino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]carbamothioylamino]butanoate Traditional Name: 4-[[(4R)-4-ethyl-2,5-diketo-4-phenyl-imidazolidin-1-yl]thiocarbamoylamino]butyric acid methyl ester Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C(=O)N1)NC(=S)NCCCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC[C@]1(C(=O)N(C(=O)N1)NC(=S)NCCCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C17H22N4O4S/c1-3-17(12-8-5-4-6-9-12)14(23)21(16(24)19-17)20-15(26)18-11-7-10-13(22)25-2/h4-6,8-9H,3,7,10-11H2,1-2H3,(H,19,24)(H2,18,20,26)/t17-/m1/s1