6-chloranyl-3-[2-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-[2-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-chloro-3-[2-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-chloro-3-[2-[1-(3-methoxypropyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-chloro-3-[2-[1-(3-methoxypropyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-chloro-3-[2-keto-2-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]ethyl]quinazolin-4-one Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCOC)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(N1CCCOC)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3O3/c1-13-9-16(14(2)24(13)7-4-8-27-3)19(25)11-23-12-22-18-6-5-15(21)10-17(18)20(23)26/h5-6,9-10,12H,4,7-8,11H2,1-3H3