2-[(Z)-1-[6-fluoranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]pentylideneamino]guanidine

Systemtic Name: 2-[(Z)-1-[6-fluoranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]pentylideneamino]guanidine Openeye Name: 2-[(Z)-1-[6-fluoro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]pentylideneamino]guanidine CAS Name: 2-[(Z)-1-[6-fluoro-1-(4-methoxyphenyl)sulfonyl-3-indolyl]pentylideneamino]guanidine IUPAC Name: 2-[(Z)-1-[6-fluoro-1-(4-methoxyphenyl)sulfonylindol-3-yl]pentylideneamino]guanidine Traditional Name: 2-[(Z)-1-[6-fluoro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]pentylideneamino]guanidine Formula: C21H24FN5O3S MolecularWeight: 445.510363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NN=C(N)N)C1=CN(C2=C1C=CC(=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC/C(=N/N=C(N)N)/C1=CN(C2=C1C=CC(=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24FN5O3S/c1-3-4-5-19(25-26-21(23)24)18-13-27(20-12-14(22)6-11-17(18)20)31(28,29)16-9-7-15(30-2)8-10-16/h6-13H,3-5H2,1-2H3,(H4,23,24,26)/b25-19-