3-(3-methoxypropyl)-2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methoxypropyl)-2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-methoxypropyl)-2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methoxypropyl)-2-[(2-methyl-3-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-methoxypropyl)-2-[(2-methyl-3-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-methoxypropyl)-2-[(2-methyl-3-nitro-benzyl)thio]quinazolin-4-one Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2CCCOC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2CCCOC

InChI

InChI=1S/C20H21N3O4S/c1-14-15(7-5-10-18(14)23(25)26)13-28-20-21-17-9-4-3-8-16(17)19(24)22(20)11-6-12-27-2/h3-5,7-10H,6,11-13H2,1-2H3