2-[1-[4-(1-phenylethylamino)quinazolin-6-yl]-4-(piperidin-1-ylmethyl)pyrrol-3-yl]ethanol

Systemtic Name: 2-[1-[4-(1-phenylethylamino)quinazolin-6-yl]-4-(piperidin-1-ylmethyl)pyrrol-3-yl]ethanol Openeye Name: 2-[1-[4-(1-phenylethylamino)quinazolin-6-yl]-4-(1-piperidylmethyl)pyrrol-3-yl]ethanol CAS Name: 2-[1-[4-(1-phenylethylamino)-6-quinazolinyl]-4-(1-piperidinylmethyl)-3-pyrrolyl]ethanol IUPAC Name: 2-[1-[4-(1-phenylethylamino)quinazolin-6-yl]-4-(piperidin-1-ylmethyl)pyrrol-3-yl]ethanol Traditional Name: 2-[1-[4-(1-phenylethylamino)quinazolin-6-yl]-4-(piperidinomethyl)pyrrol-3-yl]ethanol Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)N4C=C(C(=C4)CN5CCCCC5)CCO

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(C=C3)N4C=C(C(=C4)CN5CCCCC5)CCO

InChI

InChI=1S/C28H33N5O/c1-21(22-8-4-2-5-9-22)31-28-26-16-25(10-11-27(26)29-20-30-28)33-18-23(12-15-34)24(19-33)17-32-13-6-3-7-14-32/h2,4-5,8-11,16,18-21,34H,3,6-7,12-15,17H2,1H3,(H,29,30,31)