2-azanyl-4-(5-bromanylfuran-2-yl)-6-[(2-bromophenyl)methylamino]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanylfuran-2-yl)-6-[(2-bromophenyl)methylamino]pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-furyl)-6-[(2-bromophenyl)methylamino]pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-furanyl)-6-[(2-bromophenyl)methylamino]-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-(5-bromofuran-2-yl)-6-[(2-bromophenyl)methylamino]pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[(2-bromobenzyl)amino]-6-(5-bromo-2-furyl)pyrimidine-5-carbonitrile Formula: C16H11Br2N5O MolecularWeight: 449.09944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC(=NC(=C2C#N)C3=CC=C(O3)Br)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC(=NC(=C2C#N)C3=CC=C(O3)Br)N)Br

InChI

InChI=1S/C16H11Br2N5O/c17-11-4-2-1-3-9(11)8-21-15-10(7-19)14(22-16(20)23-15)12-5-6-13(18)24-12/h1-6H,8H2,(H3,20,21,22,23)