3-[(2-cyclopropylquinazolin-4-yl)-phenethyl-amino]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(2-cyclopropylquinazolin-4-yl)-phenethyl-amino]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(2-cyclopropylquinazolin-4-yl)-phenethyl-amino]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(2-cyclopropyl-4-quinazolinyl)-phenethylamino]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(2-cyclopropylquinazolin-4-yl)-phenethylamino]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(2-cyclopropylquinazolin-4-yl)-phenethyl-amino]-1-pyrrolidino-propan-1-one Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCN(CCC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

C1CCN(C1)C(=O)CCN(CCC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C26H30N4O/c31-24(29-16-6-7-17-29)15-19-30(18-14-20-8-2-1-3-9-20)26-22-10-4-5-11-23(22)27-25(28-26)21-12-13-21/h1-5,8-11,21H,6-7,12-19H2