7-chloranyl-3-(3-methoxypropyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3-methoxypropyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-(3-methoxypropyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(3-methoxypropyl)-2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(3-methoxypropyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=CN3

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=CN3

InChI

InChI=1S/C18H18ClN3O3S/c1-25-9-3-8-22-17(24)13-6-5-12(19)10-15(13)21-18(22)26-11-16(23)14-4-2-7-20-14/h2,4-7,10,20H,3,8-9,11H2,1H3