3-(3-chloranyl-4-methoxy-phenyl)-2-[(1R)-2-oxidanylidenecyclopentyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-2-[(1R)-2-oxidanylidenecyclopentyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-2-[(1R)-2-oxocyclopentyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-4-methoxyphenyl)-2-[[(1R)-2-oxocyclopentyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-2-[(1R)-2-oxocyclopentyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-2-[[(1R)-2-ketocyclopentyl]thio]quinazolin-4-one Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCC4=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H]4CCCC4=O)Cl

InChI

InChI=1S/C20H17ClN2O3S/c1-26-17-10-9-12(11-14(17)21)23-19(25)13-5-2-3-6-15(13)22-20(23)27-18-8-4-7-16(18)24/h2-3,5-6,9-11,18H,4,7-8H2,1H3/t18-/m1/s1