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

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-(oxolan-2-ylmethyl)quinazolin-4-amine Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-(tetrahydrofuran-2-ylmethyl)quinazolin-4-amine CAS Name: 2-[(3-nitrophenyl)methylthio]-N-(2-oxolanylmethyl)-4-quinazolinamine IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-(oxolan-2-ylmethyl)quinazolin-4-amine Traditional Name: [2-[(3-nitrobenzyl)thio]quinazolin-4-yl]-(tetrahydrofurfuryl)amine Formula: C20H20N4O3S MolecularWeight: 396.4628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC(=NC3=CC=CC=C32)SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC2=NC(=NC3=CC=CC=C32)SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c25-24(26)15-6-3-5-14(11-15)13-28-20-22-18-9-2-1-8-17(18)19(23-20)21-12-16-7-4-10-27-16/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2,(H,21,22,23)