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N4-tert-butyl-6-nitro-N2-prop-2-enyl-quinazoline-2,4-diamine hydrochloride

N4-tert-butyl-6-nitro-N2-prop-2-enyl-quinazoline-2,4-diamine hydrochloride

Systemtic Name:N4-tert-butyl-6-nitro-N2-prop-2-enyl-quinazoline-2,4-diamine hydrochloride
Openeye Name:N2-allyl-N4-tert-butyl-6-nitro-quinazoline-2,4-diamine hydrochloride
CAS Name:N4-tert-butyl-6-nitro-N2-prop-2-enylquinazoline-2,4-diamine hydrochloride
IUPAC Name:4-N-tert-butyl-6-nitro-2-N-prop-2-enylquinazoline-2,4-diamine hydrochloride
Traditional Name:allyl-[4-(tert-butylamino)-6-nitro-quinazolin-2-yl]amine hydrochloride
Formula: C15H20ClN5O2
MolecularWeight: 337.8046
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1C=C(C=C2)[N+](=O)[O-])NCC=C.Cl


Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1C=C(C=C2)[N+](=O)[O-])NCC=C.Cl


InChI

InChI=1S/C15H19N5O2.ClH/c1-5-8-16-14-17-12-7-6-10(20(21)22)9-11(12)13(18-14)19-15(2,3)4;/h5-7,9H,1,8H2,2-4H3,(H2,16,17,18,19);1H


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