N-butan-2-yl-3-[cyclohexyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide

Systemtic Name: N-butan-2-yl-3-[cyclohexyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Openeye Name: 3-[cyclohexyl-[2-(2-thienyl)quinazolin-4-yl]amino]-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-[cyclohexyl-(2-thiophen-2-yl-4-quinazolinyl)amino]propanamide IUPAC Name: N-butan-2-yl-3-[cyclohexyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Traditional Name: 3-[cyclohexyl-[2-(2-thienyl)quinazolin-4-yl]amino]-N-sec-butyl-propionamide Formula: C25H32N4OS MolecularWeight: 436.61278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CCN(C1CCCCC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CCC(C)NC(=O)CCN(C1CCCCC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C25H32N4OS/c1-3-18(2)26-23(30)15-16-29(19-10-5-4-6-11-19)25-20-12-7-8-13-21(20)27-24(28-25)22-14-9-17-31-22/h7-9,12-14,17-19H,3-6,10-11,15-16H2,1-2H3,(H,26,30)