[(3S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)piperidin-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [(3S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)piperidin-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [(3S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)-3-piperidyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [(3S)-1-(6-ethoxy-4-methyl-2-quinazolinyl)-3-piperidinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [(3S)-1-(6-ethoxy-4-methylquinazolin-2-yl)piperidin-3-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [(3S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)-3-piperidyl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCC[C@@H](C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C28H35N5O3/c1-4-36-22-11-12-24-23(18-22)20(2)29-28(30-24)33-13-7-8-21(19-33)27(34)32-16-14-31(15-17-32)25-9-5-6-10-26(25)35-3/h5-6,9-12,18,21H,4,7-8,13-17,19H2,1-3H3/t21-/m0/s1