3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]propionamide Formula: C21H23BrN4O2S MolecularWeight: 475.40192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C21H23BrN4O2S/c22-15-5-6-17-16(12-15)21(28)26(14-24-17)10-7-20(27)23-13-18(19-4-3-11-29-19)25-8-1-2-9-25/h3-6,11-12,14,18H,1-2,7-10,13H2,(H,23,27)