2-[3-methyl-5-[methyl-(2-methylsulfonylphenyl)sulfonyl-amino]phenoxy]-1-propoxy-guanidine

Systemtic Name: 2-[3-methyl-5-[methyl-(2-methylsulfonylphenyl)sulfonyl-amino]phenoxy]-1-propoxy-guanidine Openeye Name: 2-[3-methyl-5-[methyl-(2-methylsulfonylphenyl)sulfonyl-amino]phenoxy]-1-propoxy-guanidine CAS Name: 2-[3-methyl-5-[methyl-(2-methylsulfonylphenyl)sulfonylamino]phenoxy]-1-propoxyguanidine IUPAC Name: 2-[3-methyl-5-[methyl-(2-methylsulfonylphenyl)sulfonylamino]phenoxy]-1-propoxyguanidine Traditional Name: 2-[3-[(2-mesylphenyl)sulfonyl-methyl-amino]-5-methyl-phenoxy]-1-propoxy-guanidine Formula: C19H26N4O6S2 MolecularWeight: 470.56294

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Descriptors Computed from Structure

Canonical SMILES:

CCCONC(=NOC1=CC(=CC(=C1)N(C)S(=O)(=O)C2=CC=CC=C2S(=O)(=O)C)C)N

Isomeric SMILES

CCCON/C(=N\OC1=CC(=CC(=C1)N(C)S(=O)(=O)C2=CC=CC=C2S(=O)(=O)C)C)/N

InChI

InChI=1S/C19H26N4O6S2/c1-5-10-28-21-19(20)22-29-16-12-14(2)11-15(13-16)23(3)31(26,27)18-9-7-6-8-17(18)30(4,24)25/h6-9,11-13H,5,10H2,1-4H3,(H3,20,21,22)