2-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one

Systemtic Name: 2-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 2-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-3-propyl-quinazolin-4-one CAS Name: 2-[[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]thio]-3-propyl-4-quinazolinone IUPAC Name: 2-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 2-[[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl]thio]-3-propyl-quinazolin-4-one Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-3-10-23-19(25)14-6-4-5-7-16(14)22-20(23)27-12-17(24)13-8-9-18(26-2)15(21)11-13/h4-9,11H,3,10,12H2,1-2H3