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N7-ethyl-6-nitro-N4-[(2-thiomorpholin-4-ylphenyl)methyl]quinazoline-4,7-diamine

N7-ethyl-6-nitro-N4-[(2-thiomorpholin-4-ylphenyl)methyl]quinazoline-4,7-diamine

Systemtic Name:N7-ethyl-6-nitro-N4-[(2-thiomorpholin-4-ylphenyl)methyl]quinazoline-4,7-diamine
Openeye Name:N7-ethyl-6-nitro-N4-[(2-thiomorpholinophenyl)methyl]quinazoline-4,7-diamine
CAS Name:N7-ethyl-6-nitro-N4-[(2-thiomorpholin-4-ylphenyl)methyl]quinazoline-4,7-diamine
IUPAC Name:7-N-ethyl-6-nitro-4-N-[(2-thiomorpholin-4-ylphenyl)methyl]quinazoline-4,7-diamine
Traditional Name:ethyl-[6-nitro-4-[(2-thiomorpholinobenzyl)amino]quinazolin-7-yl]amine
Formula: C21H24N6O2S
MolecularWeight: 424.51926
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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3N4CCSCC4)[N+](=O)[O-]


Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3N4CCSCC4)[N+](=O)[O-]


InChI

InChI=1S/C21H24N6O2S/c1-2-22-18-12-17-16(11-20(18)27(28)29)21(25-14-24-17)23-13-15-5-3-4-6-19(15)26-7-9-30-10-8-26/h3-6,11-12,14,22H,2,7-10,13H2,1H3,(H,23,24,25)


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