3-[2-methylpropyl-(2-thiophen-2-ylquinazolin-4-yl)amino]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[2-methylpropyl-(2-thiophen-2-ylquinazolin-4-yl)amino]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[isobutyl-[2-(2-thienyl)quinazolin-4-yl]amino]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[2-methylpropyl-(2-thiophen-2-yl-4-quinazolinyl)amino]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[2-methylpropyl-(2-thiophen-2-ylquinazolin-4-yl)amino]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[isobutyl-[2-(2-thienyl)quinazolin-4-yl]amino]-1-pyrrolidino-propan-1-one Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC(=O)N1CCCC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(C)CN(CCC(=O)N1CCCC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C23H28N4OS/c1-17(2)16-27(14-11-21(28)26-12-5-6-13-26)23-18-8-3-4-9-19(18)24-22(25-23)20-10-7-15-29-20/h3-4,7-10,15,17H,5-6,11-14,16H2,1-2H3