(E)-2-(4-azanylquinazolin-2-yl)-3-(3-bromophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanylquinazolin-2-yl)-3-(3-bromophenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-aminoquinazolin-2-yl)-3-(3-bromophenyl)prop-2-enenitrile CAS Name: (E)-2-(4-amino-2-quinazolinyl)-3-(3-bromophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-aminoquinazolin-2-yl)-3-(3-bromophenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-aminoquinazolin-2-yl)-3-(3-bromophenyl)acrylonitrile Formula: C17H11BrN4 MolecularWeight: 351.20004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=CC3=CC(=CC=C3)Br)C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C(=C/C3=CC(=CC=C3)Br)/C#N)N

InChI

InChI=1S/C17H11BrN4/c18-13-5-3-4-11(9-13)8-12(10-19)17-21-15-7-2-1-6-14(15)16(20)22-17/h1-9H,(H2,20,21,22)/b12-8+