2,3-dihydroindol-1-yl-[3-nitro-4-(pyridin-3-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: 2,3-dihydroindol-1-yl-[3-nitro-4-(pyridin-3-ylmethylsulfanyl)phenyl]methanone Openeye Name: indolin-1-yl-[3-nitro-4-(3-pyridylmethylsulfanyl)phenyl]methanone CAS Name: 2,3-dihydroindol-1-yl-[3-nitro-4-(3-pyridinylmethylthio)phenyl]methanone IUPAC Name: 2,3-dihydroindol-1-yl-[3-nitro-4-(pyridin-3-ylmethylsulfanyl)phenyl]methanone Traditional Name: indolin-1-yl-[3-nitro-4-(3-pyridylmethylthio)phenyl]methanone Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)SCC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)SCC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O3S/c25-21(23-11-9-16-5-1-2-6-18(16)23)17-7-8-20(19(12-17)24(26)27)28-14-15-4-3-10-22-13-15/h1-8,10,12-13H,9,11,14H2