2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(cyclohexylmethyl)ethanamide

Systemtic Name: 2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(cyclohexylmethyl)ethanamide Openeye Name: N-(cyclohexylmethyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(cyclohexylmethyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(cyclohexylmethyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(cyclohexylmethyl)-2-[(5,6-diamino-4-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C13H21N5O2S MolecularWeight: 311.40314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CSC2=NC(=O)C(=C(N2)N)N

Isomeric SMILES

C1CCC(CC1)CNC(=O)CSC2=NC(=O)C(=C(N2)N)N

InChI

InChI=1S/C13H21N5O2S/c14-10-11(15)17-13(18-12(10)20)21-7-9(19)16-6-8-4-2-1-3-5-8/h8H,1-7,14H2,(H,16,19)(H3,15,17,18,20)