N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(cyanomethylsulfanyl)-N-propyl-ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(cyanomethylsulfanyl)-N-propyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(cyanomethylsulfanyl)-N-propyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(cyanomethylthio)-N-propylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(cyanomethylsulfanyl)-N-propylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(cyanomethylthio)-N-propyl-acetamide Formula: C15H23N5O3S MolecularWeight: 353.43982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)CSCC#N)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)CSCC#N)N

InChI

InChI=1S/C15H23N5O3S/c1-3-5-8-20-13(17)12(14(22)18-15(20)23)19(7-4-2)11(21)10-24-9-6-16/h3-5,7-10,17H2,1-2H3,(H,18,22,23)