4-(azepan-1-yl)-6-bromanyl-2-phenyl-quinazoline

Systemtic Name: 4-(azepan-1-yl)-6-bromanyl-2-phenyl-quinazoline Openeye Name: 4-(azepan-1-yl)-6-bromo-2-phenyl-quinazoline CAS Name: 4-(1-azepanyl)-6-bromo-2-phenylquinazoline IUPAC Name: 4-(azepan-1-yl)-6-bromo-2-phenylquinazoline Traditional Name: 4-(azepan-1-yl)-6-bromo-2-phenyl-quinazoline Formula: C20H20BrN3 MolecularWeight: 382.2969

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C20H20BrN3/c21-16-10-11-18-17(14-16)20(24-12-6-1-2-7-13-24)23-19(22-18)15-8-4-3-5-9-15/h3-5,8-11,14H,1-2,6-7,12-13H2