(Z)-3-azanyl-2,4-bis-(4-methylphenyl)sulfonyl-but-2-enenitrile

Systemtic Name: (Z)-3-azanyl-2,4-bis-(4-methylphenyl)sulfonyl-but-2-enenitrile Openeye Name: (Z)-3-amino-2,4-bis(p-tolylsulfonyl)but-2-enenitrile CAS Name: (Z)-3-amino-2,4-bis-(4-methylphenyl)sulfonyl-2-butenenitrile IUPAC Name: (Z)-3-amino-2,4-bis-(4-methylphenyl)sulfonylbut-2-enenitrile Traditional Name: (Z)-3-amino-2,4-ditosyl-but-2-enenitrile Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C/C(=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)C)/N

InChI

InChI=1S/C18H18N2O4S2/c1-13-3-7-15(8-4-13)25(21,22)12-17(20)18(11-19)26(23,24)16-9-5-14(2)6-10-16/h3-10H,12,20H2,1-2H3/b18-17-