(2Z)-5-chloranyl-2-(4-methyl-5-propyl-1,3-dihydroimidazol-2-ylidene)-3-(phenylsulfonyl)indole

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C2C(=C3C=C(C=CC3=N2)Cl)S(=O)(=O)C4=CC=CC=C4)N1)C

Isomeric SMILES

CCCC1=C(N/C(=C/2\C(=C3C=C(C=CC3=N2)Cl)S(=O)(=O)C4=CC=CC=C4)/N1)C

InChI

InChI=1S/C21H20ClN3O2S/c1-3-7-17-13(2)23-21(25-17)19-20(16-12-14(22)10-11-18(16)24-19)28(26,27)15-8-5-4-6-9-15/h4-6,8-12,23,25H,3,7H2,1-2H3/b21-19-