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methyl 4-[2-[1-ethyl-5-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate

methyl 4-[2-[1-ethyl-5-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate

Systemtic Name:methyl 4-[2-[1-ethyl-5-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate
Openeye Name:methyl 4-[[2-(3-benzyl-1-ethyl-5-oxo-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoate
CAS Name:4-[[2-[1-ethyl-5-oxo-3-(phenylmethyl)-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 4-[[2-(3-benzyl-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetyl]amino]benzoate
Traditional Name:4-[[2-(3-benzyl-1-ethyl-5-keto-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoic acid methyl ester
Formula: C22H23N3O4S
MolecularWeight: 425.50072
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(N(C1=S)CC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C(=O)OC


Isomeric SMILES

CCN1C(=O)C(N(C1=S)CC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C(=O)OC


InChI

InChI=1S/C22H23N3O4S/c1-3-24-20(27)18(25(22(24)30)14-15-7-5-4-6-8-15)13-19(26)23-17-11-9-16(10-12-17)21(28)29-2/h4-12,18H,3,13-14H2,1-2H3,(H,23,26)


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