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

Systemtic Name: N-(2-methylpropyl)-3-[phenethyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Openeye Name: N-isobutyl-3-[phenethyl-[2-(2-thienyl)quinazolin-4-yl]amino]propanamide CAS Name: N-(2-methylpropyl)-3-[phenethyl-(2-thiophen-2-yl-4-quinazolinyl)amino]propanamide IUPAC Name: N-(2-methylpropyl)-3-[phenethyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Traditional Name: N-isobutyl-3-[phenethyl-[2-(2-thienyl)quinazolin-4-yl]amino]propionamide Formula: C27H30N4OS MolecularWeight: 458.6183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCN(CCC1=CC=CC=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(C)CNC(=O)CCN(CCC1=CC=CC=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C27H30N4OS/c1-20(2)19-28-25(32)15-17-31(16-14-21-9-4-3-5-10-21)27-22-11-6-7-12-23(22)29-26(30-27)24-13-8-18-33-24/h3-13,18,20H,14-17,19H2,1-2H3,(H,28,32)