N-(2-methoxyethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine

Systemtic Name: N-(2-methoxyethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine Openeye Name: N-(2-methoxyethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine CAS Name: N-(2-methoxyethyl)-2-[(3-nitrophenyl)methylthio]-4-quinazolinamine IUPAC Name: N-(2-methoxyethyl)-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-amine Traditional Name: 2-methoxyethyl-[2-[(3-nitrobenzyl)thio]quinazolin-4-yl]amine Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=CC=CC=C21)SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=NC(=NC2=CC=CC=C21)SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3S/c1-25-10-9-19-17-15-7-2-3-8-16(15)20-18(21-17)26-12-13-5-4-6-14(11-13)22(23)24/h2-8,11H,9-10,12H2,1H3,(H,19,20,21)