2-[4-chloranyl-3-(2-methoxypyrrolidin-1-yl)sulfonyl-2-oxidanyl-phenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine

Systemtic Name: 2-[4-chloranyl-3-(2-methoxypyrrolidin-1-yl)sulfonyl-2-oxidanyl-phenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine Openeye Name: 2-[4-chloro-2-hydroxy-3-(2-methoxypyrrolidin-1-yl)sulfonyl-phenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine CAS Name: 2-[4-chloro-2-hydroxy-3-[(2-methoxy-1-pyrrolidinyl)sulfonyl]phenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine IUPAC Name: 2-[4-chloro-2-hydroxy-3-(2-methoxypyrrolidin-1-yl)sulfonylphenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine Traditional Name: 2-[4-chloro-2-hydroxy-3-(2-methoxypyrrolidino)sulfonyl-phenyl]-1-cyano-3-(2-phenoxyphenyl)guanidine Formula: C25H24ClN5O5S MolecularWeight: 542.00656

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN1S(=O)(=O)C2=C(C=CC(=C2O)N=C(NC#N)NC3=CC=CC=C3OC4=CC=CC=C4)Cl

Isomeric SMILES

COC1CCCN1S(=O)(=O)C2=C(C=CC(=C2O)N=C(NC#N)NC3=CC=CC=C3OC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H24ClN5O5S/c1-35-22-12-7-15-31(22)37(33,34)24-18(26)13-14-20(23(24)32)30-25(28-16-27)29-19-10-5-6-11-21(19)36-17-8-3-2-4-9-17/h2-6,8-11,13-14,22,32H,7,12,15H2,1H3,(H2,28,29,30)