7-chloranyl-2-[(2-ethoxyphenyl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(2-ethoxyphenyl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(2-ethoxyphenyl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one CAS Name: 7-chloro-2-[(2-ethoxyphenyl)methylthio]-3-(3-methoxypropyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(2-ethoxyphenyl)methylsulfanyl]-3-(3-methoxypropyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(2-ethoxybenzyl)thio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

Isomeric SMILES

CCOC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

InChI

InChI=1S/C21H23ClN2O3S/c1-3-27-19-8-5-4-7-15(19)14-28-21-23-18-13-16(22)9-10-17(18)20(25)24(21)11-6-12-26-2/h4-5,7-10,13H,3,6,11-12,14H2,1-2H3