2-azanylidene-3-[(5-bromanylthiophen-2-yl)methyl]-1-(2-piperidin-1-ylethyl)quinazolin-4-one

Systemtic Name: 2-azanylidene-3-[(5-bromanylthiophen-2-yl)methyl]-1-(2-piperidin-1-ylethyl)quinazolin-4-one Openeye Name: 3-[(5-bromo-2-thienyl)methyl]-2-imino-1-[2-(1-piperidyl)ethyl]quinazolin-4-one CAS Name: 3-[(5-bromo-2-thiophenyl)methyl]-2-imino-1-[2-(1-piperidinyl)ethyl]-4-quinazolinone IUPAC Name: 3-[(5-bromothiophen-2-yl)methyl]-2-imino-1-(2-piperidin-1-ylethyl)quinazolin-4-one Traditional Name: 3-[(5-bromo-2-thienyl)methyl]-2-imino-1-(2-piperidinoethyl)quinazolin-4-one Formula: C20H23BrN4OS MolecularWeight: 447.39182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C3=CC=CC=C3C(=O)N(C2=N)CC4=CC=C(S4)Br

Isomeric SMILES

C1CCN(CC1)CCN2C3=CC=CC=C3C(=O)N(C2=N)CC4=CC=C(S4)Br

InChI

InChI=1S/C20H23BrN4OS/c21-18-9-8-15(27-18)14-25-19(26)16-6-2-3-7-17(16)24(20(25)22)13-12-23-10-4-1-5-11-23/h2-3,6-9,22H,1,4-5,10-14H2