1-[(2S)-2-ethylhexyl]-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea

Systemtic Name: 1-[(2S)-2-ethylhexyl]-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea Openeye Name: 1-[(2S)-2-ethylhexyl]-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-[(2S)-2-ethylhexyl]-3-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]thiourea IUPAC Name: 1-[(2S)-2-ethylhexyl]-3-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]thiourea Traditional Name: 1-[(2S)-2-ethylhexyl]-3-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea Formula: C15H25N5O2S2 MolecularWeight: 371.5213

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NNC(=O)CC1=CC(=O)NC(=S)N1

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NNC(=O)CC1=CC(=O)NC(=S)N1

InChI

InChI=1S/C15H25N5O2S2/c1-3-5-6-10(4-2)9-16-14(23)20-19-13(22)8-11-7-12(21)18-15(24)17-11/h7,10H,3-6,8-9H2,1-2H3,(H,19,22)(H2,16,20,23)(H2,17,18,21,24)/t10-/m0/s1