N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-tert-butylsulfanyl-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-tert-butylsulfanyl-N-(furan-2-ylmethyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-tert-butylsulfanyl-N-(2-furylmethyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(tert-butylthio)-N-(2-furanylmethyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-tert-butylsulfanyl-N-(furan-2-ylmethyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(tert-butylthio)-N-(2-furfuryl)acetamide Formula: C19H28N4O4S MolecularWeight: 408.51502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)CSC(C)(C)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)CSC(C)(C)C)N

InChI

InChI=1S/C19H28N4O4S/c1-5-6-9-22-16(20)15(17(25)21-18(22)26)23(11-13-8-7-10-27-13)14(24)12-28-19(2,3)4/h7-8,10H,5-6,9,11-12,20H2,1-4H3,(H,21,25,26)