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

Systemtic Name: 2-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-3-cyclopropyl-quinazolin-4-one Openeye Name: 2-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]thio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-cyclopropylquinazolin-4-one Traditional Name: 2-[[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl]thio]-3-cyclopropyl-quinazolin-4-one Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)Cl

InChI

InChI=1S/C20H17ClN2O3S/c1-26-18-9-6-12(10-15(18)21)17(24)11-27-20-22-16-5-3-2-4-14(16)19(25)23(20)13-7-8-13/h2-6,9-10,13H,7-8,11H2,1H3