(6E)-6-[4-[[(2R)-2-azanyl-3-methyl-butyl]amino]-1H-quinazolin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-[[(2R)-2-azanyl-3-methyl-butyl]amino]-1H-quinazolin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-[[(2R)-2-amino-3-methyl-butyl]amino]-1H-quinazolin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-[[(2R)-2-amino-3-methylbutyl]amino]-1H-quinazolin-2-ylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-[[(2R)-2-amino-3-methylbutyl]amino]-1H-quinazolin-2-ylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-[[(2R)-2-amino-3-methyl-butyl]amino]-1H-quinazolin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C20H24N4O MolecularWeight: 336.43076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2NC3=CC=CC=C3C(=N2)NCC(C(C)C)N)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C\2/NC3=CC=CC=C3C(=N2)NC[C@@H](C(C)C)N)/C(=O)C=C1

InChI

InChI=1S/C20H24N4O/c1-12(2)16(21)11-22-19-14-6-4-5-7-17(14)23-20(24-19)15-10-13(3)8-9-18(15)25/h4-10,12,16,23H,11,21H2,1-3H3,(H,22,24)/b20-15+/t16-/m0/s1