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

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

Systemtic Name:N4-cyclopentyl-6-nitro-N2-prop-2-enyl-quinazoline-2,4-diamine hydrochloride
Openeye Name:N2-allyl-N4-cyclopentyl-6-nitro-quinazoline-2,4-diamine hydrochloride
CAS Name:N4-cyclopentyl-6-nitro-N2-prop-2-enylquinazoline-2,4-diamine hydrochloride
IUPAC Name:4-N-cyclopentyl-6-nitro-2-N-prop-2-enylquinazoline-2,4-diamine hydrochloride
Traditional Name:allyl-[4-(cyclopentylamino)-6-nitro-quinazolin-2-yl]amine hydrochloride
Formula: C16H20ClN5O2
MolecularWeight: 349.8153
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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NC3CCCC3.Cl


Isomeric SMILES

C=CCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NC3CCCC3.Cl


InChI

InChI=1S/C16H19N5O2.ClH/c1-2-9-17-16-19-14-8-7-12(21(22)23)10-13(14)15(20-16)18-11-5-3-4-6-11;/h2,7-8,10-11H,1,3-6,9H2,(H2,17,18,19,20);1H


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