N-(3-azanylpropyl)-4-bromanyl-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]-2-oxidanylidene-2-pyrrolidin-1-yl-ethyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-bromanyl-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]-2-oxidanylidene-2-pyrrolidin-1-yl-ethyl]benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)-2-oxo-2-pyrrolidin-1-yl-ethyl]-4-bromo-benzamide CAS Name: N-(3-aminopropyl)-4-bromo-N-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]-2-oxo-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)-2-oxo-2-pyrrolidin-1-ylethyl]-4-bromobenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)-2-keto-2-pyrrolidino-ethyl]-4-bromo-benzamide Formula: C31H31BrClN5O3 MolecularWeight: 636.96654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4=CC=CC=C4)N(CCCN)C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CCN(C1)C(=O)C(C2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4=CC=CC=C4)N(CCCN)C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C31H31BrClN5O3/c32-23-11-9-22(10-12-23)29(39)37(18-6-15-34)27(31(41)36-16-4-5-17-36)28-35-26-19-24(33)13-14-25(26)30(40)38(28)20-21-7-2-1-3-8-21/h1-3,7-14,19,27H,4-6,15-18,20,34H2