1-(2-bromophenyl)-1-cyano-2-[4-cyano-3-(2-methylpropyl)-2-oxidanyl-phenyl]guanidine

Systemtic Name: 1-(2-bromophenyl)-1-cyano-2-[4-cyano-3-(2-methylpropyl)-2-oxidanyl-phenyl]guanidine Openeye Name: 1-(2-bromophenyl)-1-cyano-2-(4-cyano-2-hydroxy-3-isobutyl-phenyl)guanidine CAS Name: 1-(2-bromophenyl)-1-cyano-2-[4-cyano-2-hydroxy-3-(2-methylpropyl)phenyl]guanidine IUPAC Name: 1-(2-bromophenyl)-1-cyano-2-[4-cyano-2-hydroxy-3-(2-methylpropyl)phenyl]guanidine Traditional Name: 1-(2-bromophenyl)-1-cyano-2-(4-cyano-2-hydroxy-3-isobutyl-phenyl)guanidine Formula: C19H18BrN5O MolecularWeight: 412.28312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1O)N=C(N)N(C#N)C2=CC=CC=C2Br)C#N

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1O)N=C(N)N(C#N)C2=CC=CC=C2Br)C#N

InChI

InChI=1S/C19H18BrN5O/c1-12(2)9-14-13(10-21)7-8-16(18(14)26)24-19(23)25(11-22)17-6-4-3-5-15(17)20/h3-8,12,26H,9H2,1-2H3,(H2,23,24)