6-[4-[[(2S)-butan-2-yl]amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-[[(2S)-butan-2-yl]amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-[[(1S)-1-methylpropyl]amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-[[(2S)-butan-2-yl]amino]-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-[[(2S)-butan-2-yl]amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-[[(1S)-1-methylpropyl]amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC(=C2C=CC=CC2=O)NC3=CC=CC=C31

Isomeric SMILES

CC[C@H](C)NC1=NC(=C2C=CC=CC2=O)NC3=CC=CC=C31

InChI

InChI=1S/C18H19N3O/c1-3-12(2)19-17-13-8-4-6-10-15(13)20-18(21-17)14-9-5-7-11-16(14)22/h4-12,20H,3H2,1-2H3,(H,19,21)/t12-/m0/s1