1-(4-bromophenyl)-3-[4-[2-[(4-methylphenoxy)methyl]-4-oxidanylidene-quinazolin-3-yl]phenyl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[4-[2-[(4-methylphenoxy)methyl]-4-oxidanylidene-quinazolin-3-yl]phenyl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[4-[2-[(4-methylphenoxy)methyl]-4-oxo-quinazolin-3-yl]phenyl]thiourea CAS Name: 1-(4-bromophenyl)-3-[4-[2-[(4-methylphenoxy)methyl]-4-oxo-3-quinazolinyl]phenyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[4-[2-[(4-methylphenoxy)methyl]-4-oxoquinazolin-3-yl]phenyl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[4-[4-keto-2-[(4-methylphenoxy)methyl]quinazolin-3-yl]phenyl]thiourea Formula: C29H23BrN4O2S MolecularWeight: 571.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)NC(=S)NC5=CC=C(C=C5)Br

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)NC(=S)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C29H23BrN4O2S/c1-19-6-16-24(17-7-19)36-18-27-33-26-5-3-2-4-25(26)28(35)34(27)23-14-12-22(13-15-23)32-29(37)31-21-10-8-20(30)9-11-21/h2-17H,18H2,1H3,(H2,31,32,37)