3-[[6-methyl-4-(prop-2-enylamino)quinazolin-2-yl]amino]-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-[[6-methyl-4-(prop-2-enylamino)quinazolin-2-yl]amino]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[[4-(allylamino)-6-methyl-quinazolin-2-yl]amino]-1-(1-piperidyl)propan-1-one CAS Name: 3-[[6-methyl-4-(prop-2-enylamino)-2-quinazolinyl]amino]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[[6-methyl-4-(prop-2-enylamino)quinazolin-2-yl]amino]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[[4-(allylamino)-6-methyl-quinazolin-2-yl]amino]-1-piperidino-propan-1-one Formula: C20H27N5O MolecularWeight: 353.46128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NCC=C)NCCC(=O)N3CCCCC3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NCC=C)NCCC(=O)N3CCCCC3

InChI

InChI=1S/C20H27N5O/c1-3-10-21-19-16-14-15(2)7-8-17(16)23-20(24-19)22-11-9-18(26)25-12-5-4-6-13-25/h3,7-8,14H,1,4-6,9-13H2,2H3,(H2,21,22,23,24)