7-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(4-nitrophenyl)methylsulfanyl]-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 7-chloro-2-[(4-nitrophenyl)methylthio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(4-nitrophenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(4-nitrobenzyl)thio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O4S/c21-14-5-8-17-18(10-14)22-20(23(19(17)25)11-16-2-1-9-28-16)29-12-13-3-6-15(7-4-13)24(26)27/h3-8,10,16H,1-2,9,11-12H2