N-[(1S)-1-(4-bromophenyl)propyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: N-[(1S)-1-(4-bromophenyl)propyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[(1S)-1-(4-bromophenyl)propyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: N-[(1S)-1-(4-bromophenyl)propyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-[(1S)-1-(4-bromophenyl)propyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: N-[(1S)-1-(4-bromophenyl)propyl]-9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrN3O2/c1-2-17(13-5-8-15(22)9-6-13)24-20(26)14-7-10-16-18(12-14)23-19-4-3-11-25(19)21(16)27/h5-10,12,17H,2-4,11H2,1H3,(H,24,26)/t17-/m0/s1