2-[[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]methyl]-7-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]methyl]-7-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[(5-bromo-2-thienyl)methyl-ethyl-amino]methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 2-[[(5-bromo-2-thiophenyl)methyl-ethylamino]methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[(5-bromothiophen-2-yl)methyl-ethylamino]methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[[(5-bromo-2-thienyl)methyl-ethyl-amino]methyl]-7-chloro-1H-quinazolin-4-one Formula: C16H15BrClN3OS MolecularWeight: 412.7318

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H15BrClN3OS/c1-2-21(8-11-4-6-14(17)23-11)9-15-19-13-7-10(18)3-5-12(13)16(22)20-15/h3-7H,2,8-9H2,1H3,(H,19,20,22)