N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-4-(trifluoromethylsulfonyl)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-4-(trifluoromethylsulfonyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-4-(trifluoromethylsulfonyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-4-(trifluoromethylsulfonyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-4-(trifluoromethylsulfonyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-4-triflyl-benzamide Formula: C20H25F3N4O5S MolecularWeight: 490.49651

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)N

InChI

InChI=1S/C20H25F3N4O5S/c1-3-5-11-26(15-16(24)27(12-6-4-2)19(30)25-17(15)28)18(29)13-7-9-14(10-8-13)33(31,32)20(21,22)23/h7-10H,3-6,11-12,24H2,1-2H3,(H,25,28,30)