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

Systemtic Name: 2-[(Z)-1-[1-(3,4-dimethoxyphenyl)sulfonyl-6-fluoranyl-indol-3-yl]pentylideneamino]guanidine Openeye Name: 2-[(Z)-1-[1-(3,4-dimethoxyphenyl)sulfonyl-6-fluoro-indol-3-yl]pentylideneamino]guanidine CAS Name: 2-[(Z)-1-[1-(3,4-dimethoxyphenyl)sulfonyl-6-fluoro-3-indolyl]pentylideneamino]guanidine IUPAC Name: 2-[(Z)-1-[1-(3,4-dimethoxyphenyl)sulfonyl-6-fluoroindol-3-yl]pentylideneamino]guanidine Traditional Name: 2-[(Z)-1-[1-(3,4-dimethoxyphenyl)sulfonyl-6-fluoro-indol-3-yl]pentylideneamino]guanidine Formula: C22H26FN5O4S MolecularWeight: 475.536343

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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)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)OC

InChI

InChI=1S/C22H26FN5O4S/c1-4-5-6-18(26-27-22(24)25)17-13-28(19-11-14(23)7-9-16(17)19)33(29,30)15-8-10-20(31-2)21(12-15)32-3/h7-13H,4-6H2,1-3H3,(H4,24,25,27)/b26-18-