N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-5-bromanyl-pyridin-2-amine

Systemtic Name: N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-5-bromanyl-pyridin-2-amine Openeye Name: N-[2,2-bis(p-tolylsulfonyl)vinyl]-5-bromo-pyridin-2-amine CAS Name: N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-5-bromo-2-pyridinamine IUPAC Name: N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-5-bromopyridin-2-amine Traditional Name: (5-bromo-2-pyridyl)-(2,2-ditosylvinyl)amine Formula: C21H19BrN2O4S2 MolecularWeight: 507.42056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H19BrN2O4S2/c1-15-3-8-18(9-4-15)29(25,26)21(14-24-20-12-7-17(22)13-23-20)30(27,28)19-10-5-16(2)6-11-19/h3-14H,1-2H3,(H,23,24)