6-bromanyl-3-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 3-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-6-bromo-quinazolin-4-one CAS Name: 6-bromo-3-[2-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-6-bromo-quinazolin-4-one Formula: C19H18BrN3O2 MolecularWeight: 400.26912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3O2/c1-4-7-23-12(2)8-15(13(23)3)18(24)10-22-11-21-17-6-5-14(20)9-16(17)19(22)25/h4-6,8-9,11H,1,7,10H2,2-3H3