2-[(3-methoxyphenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-3-(4-nitrophenyl)-4-quinazolinone IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Traditional Name: 2-(m-anisylthio)-3-(4-nitrophenyl)quinazolin-4-one Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4S/c1-29-18-6-4-5-15(13-18)14-30-22-23-20-8-3-2-7-19(20)21(26)24(22)16-9-11-17(12-10-16)25(27)28/h2-13H,14H2,1H3