1-(5-oxidanylidene-1,2,3,9b-tetrahydropyrrolo[2,1-a]isoindol-9-yl)-3-[5-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]-1H-pyrazol-3-yl]urea

Systemtic Name: 1-(5-oxidanylidene-1,2,3,9b-tetrahydropyrrolo[2,1-a]isoindol-9-yl)-3-[5-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]-1H-pyrazol-3-yl]urea Openeye Name: 1-[5-[(2S)-1-benzylpyrrolidin-2-yl]-1H-pyrazol-3-yl]-3-(5-oxo-1,2,3,9b-tetrahydropyrrolo[2,1-a]isoindol-9-yl)urea CAS Name: 1-(5-oxo-1,2,3,9b-tetrahydropyrrolo[2,1-a]isoindol-9-yl)-3-[5-[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]-1H-pyrazol-3-yl]urea IUPAC Name: 1-[5-[(2S)-1-benzylpyrrolidin-2-yl]-1H-pyrazol-3-yl]-3-(5-oxo-1,2,3,9b-tetrahydropyrrolo[2,1-a]isoindol-9-yl)urea Traditional Name: 1-[5-[(2S)-1-benzylpyrrolidin-2-yl]-1H-pyrazol-3-yl]-3-(5-keto-1,2,3,9b-tetrahydropyrrol[2,1-a]isoindol-9-yl)urea Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=CC=CC=C2)C3=CC(=NN3)NC(=O)NC4=CC=CC5=C4C6CCCN6C5=O

Isomeric SMILES

C1C[C@H](N(C1)CC2=CC=CC=C2)C3=CC(=NN3)NC(=O)NC4=CC=CC5=C4C6CCCN6C5=O

InChI

InChI=1S/C26H28N6O2/c33-25-18-9-4-10-19(24(18)22-12-6-14-32(22)25)27-26(34)28-23-15-20(29-30-23)21-11-5-13-31(21)16-17-7-2-1-3-8-17/h1-4,7-10,15,21-22H,5-6,11-14,16H2,(H3,27,28,29,30,34)/t21-,22?/m0/s1