N-[2-[(2S)-butan-2-yl]phenyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: N-[2-[(2S)-butan-2-yl]phenyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[2-[(1S)-1-methylpropyl]phenyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: N-[2-[(2S)-butan-2-yl]phenyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-[2-[(2S)-butan-2-yl]phenyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: 9-keto-N-[2-[(1S)-1-methylpropyl]phenyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

InChI

InChI=1S/C22H23N3O2/c1-3-14(2)16-7-4-5-8-18(16)24-21(26)15-10-11-17-19(13-15)23-20-9-6-12-25(20)22(17)27/h4-5,7-8,10-11,13-14H,3,6,9,12H2,1-2H3,(H,24,26)/t14-/m0/s1