1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-3-cyclohexyl-propan-1-one

Systemtic Name: 1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-3-cyclohexyl-propan-1-one Openeye Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-3-cyclohexyl-propan-1-one CAS Name: 1-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-3-cyclohexyl-1-propanone IUPAC Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-3-cyclohexylpropan-1-one Traditional Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-3-cyclohexyl-propan-1-one Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1CCC(CC1)CCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C22H31N5O/c23-22-18-8-4-5-9-19(18)24-20(25-22)16-26-12-14-27(15-13-26)21(28)11-10-17-6-2-1-3-7-17/h4-5,8-9,17H,1-3,6-7,10-16H2,(H2,23,24,25)