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

Systemtic Name: 1-butyl-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea Openeye Name: 1-butyl-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-butyl-3-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]thiourea IUPAC Name: 1-butyl-3-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]thiourea Traditional Name: 1-butyl-3-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea Formula: C11H17N5O2S2 MolecularWeight: 315.41498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)CC1=CC(=O)NC(=S)N1

Isomeric SMILES

CCCCNC(=S)NNC(=O)CC1=CC(=O)NC(=S)N1

InChI

InChI=1S/C11H17N5O2S2/c1-2-3-4-12-10(19)16-15-9(18)6-7-5-8(17)14-11(20)13-7/h5H,2-4,6H2,1H3,(H,15,18)(H2,12,16,19)(H2,13,14,17,20)