N7-ethyl-6-nitro-N4-(3-thiomorpholin-4-ylpropyl)quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-6-nitro-N4-(3-thiomorpholin-4-ylpropyl)quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-(3-thiomorpholinopropyl)quinazoline-4,7-diamine CAS Name: N7-ethyl-6-nitro-N4-(3-thiomorpholin-4-ylpropyl)quinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-6-nitro-4-N-(3-thiomorpholin-4-ylpropyl)quinazoline-4,7-diamine Traditional Name: ethyl-[6-nitro-4-(3-thiomorpholinopropylamino)quinazolin-7-yl]amine Formula: C17H24N6O2S MolecularWeight: 376.47646

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCCCN3CCSCC3)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCCCN3CCSCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H24N6O2S/c1-2-18-15-11-14-13(10-16(15)23(24)25)17(21-12-20-14)19-4-3-5-22-6-8-26-9-7-22/h10-12,18H,2-9H2,1H3,(H,19,20,21)