[2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium

Systemtic Name: [2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium Openeye Name: [2-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]phenyl]methyl-cyclohexyl-methyl-ammonium CAS Name: [2-[[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]amino]phenyl]methyl-cyclohexyl-methylammonium IUPAC Name: [2-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl]methyl-cyclohexyl-methylazanium Traditional Name: [2-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]benzyl]-cyclohexyl-methyl-ammonium Formula: C21H27N4S+ MolecularWeight: 367.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=CC=CC=C2C[NH+](C)C3CCCCC3)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=CC=CC=C2C[NH+](C)C3CCCCC3)/C#N

InChI

InChI=1S/C21H26N4S/c1-16-15-26-21(24-16)18(12-22)13-23-20-11-7-6-8-17(20)14-25(2)19-9-4-3-5-10-19/h6-8,11,13,15,19,23H,3-5,9-10,14H2,1-2H3/p+1/b18-13+