butyl-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: butyl-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: butyl-[2-(tert-butylcarbamoylamino)-2-oxo-ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: butyl-[2-(tert-butylcarbamoylamino)-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: butyl-[2-(tert-butylcarbamoylamino)-2-keto-ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C20H30N5O3+ MolecularWeight: 388.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC(=O)NC(C)(C)C

Isomeric SMILES

CCCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C20H29N5O3/c1-5-6-11-25(13-17(26)23-19(28)24-20(2,3)4)12-16-21-15-10-8-7-9-14(15)18(27)22-16/h7-10H,5-6,11-13H2,1-4H3,(H,21,22,27)(H2,23,24,26,28)/p+1