N-(2-methylpropyl)-3-[propyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide

Systemtic Name: N-(2-methylpropyl)-3-[propyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Openeye Name: N-isobutyl-3-[propyl-[2-(2-thienyl)quinazolin-4-yl]amino]propanamide CAS Name: N-(2-methylpropyl)-3-[propyl-(2-thiophen-2-yl-4-quinazolinyl)amino]propanamide IUPAC Name: N-(2-methylpropyl)-3-[propyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Traditional Name: N-isobutyl-3-[propyl-[2-(2-thienyl)quinazolin-4-yl]amino]propionamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)NCC(C)C)C1=NC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CCCN(CCC(=O)NCC(C)C)C1=NC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C22H28N4OS/c1-4-12-26(13-11-20(27)23-15-16(2)3)22-17-8-5-6-9-18(17)24-21(25-22)19-10-7-14-28-19/h5-10,14,16H,4,11-13,15H2,1-3H3,(H,23,27)