5-chloranyl-2-(4,5-diethyl-1,3-dihydroimidazol-2-ylidene)-3-(phenylsulfonyl)indole

Systemtic Name: 5-chloranyl-2-(4,5-diethyl-1,3-dihydroimidazol-2-ylidene)-3-(phenylsulfonyl)indole Openeye Name: 3-(benzenesulfonyl)-5-chloro-2-(4,5-diethyl-1,3-dihydroimidazol-2-ylidene)indole CAS Name: 3-(benzenesulfonyl)-5-chloro-2-(4,5-diethyl-1,3-dihydroimidazol-2-ylidene)indole IUPAC Name: 3-(benzenesulfonyl)-5-chloro-2-(4,5-diethyl-1,3-dihydroimidazol-2-ylidene)indole Traditional Name: 3-besyl-5-chloro-2-(4,5-diethyl-4-imidazolin-2-ylidene)indole Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C2C(=C3C=C(C=CC3=N2)Cl)S(=O)(=O)C4=CC=CC=C4)N1)CC

Isomeric SMILES

CCC1=C(NC(=C2C(=C3C=C(C=CC3=N2)Cl)S(=O)(=O)C4=CC=CC=C4)N1)CC

InChI

InChI=1S/C21H20ClN3O2S/c1-3-16-17(4-2)25-21(24-16)19-20(15-12-13(22)10-11-18(15)23-19)28(26,27)14-8-6-5-7-9-14/h5-12,24-25H,3-4H2,1-2H3