6-bromanyl-2-methyl-3-(thiophen-2-ylmethyl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6-bromanyl-2-methyl-3-(thiophen-2-ylmethyl)-4aH-quinazolin-3-ium-4-one Openeye Name: 6-bromo-2-methyl-3-(2-thienylmethyl)-4aH-quinazolin-3-ium-4-one CAS Name: 6-bromo-2-methyl-3-(thiophen-2-ylmethyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-bromo-2-methyl-3-(thiophen-2-ylmethyl)-4aH-quinazolin-3-ium-4-one Traditional Name: 6-bromo-2-methyl-3-(2-thenyl)-4aH-quinazolin-3-ium-4-one Formula: C14H12BrN2OS+ MolecularWeight: 336.22688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2C=C(C=CC2=N1)Br)CC3=CC=CS3

Isomeric SMILES

CC1=[N+](C(=O)C2C=C(C=CC2=N1)Br)CC3=CC=CS3

InChI

InChI=1S/C14H12BrN2OS/c1-9-16-13-5-4-10(15)7-12(13)14(18)17(9)8-11-3-2-6-19-11/h2-7,12H,8H2,1H3/q+1