methyl N-[(S)-benzotriazol-1-yl(phenyl)methyl]benzenecarboximidothioate

Systemtic Name: methyl N-[(S)-benzotriazol-1-yl(phenyl)methyl]benzenecarboximidothioate Openeye Name: methyl N-[(S)-benzotriazol-1-yl(phenyl)methyl]benzenecarboximidothioate CAS Name: N-[(S)-1-benzotriazolyl(phenyl)methyl]benzenecarboximidothioic acid methyl ester IUPAC Name: methyl N-[(S)-benzotriazol-1-yl(phenyl)methyl]benzenecarboximidothioate Traditional Name: N-[(S)-benzotriazol-1-yl(phenyl)methyl]benzenecarboximidothioic acid methyl ester Formula: C21H18N4S MolecularWeight: 358.45942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(C1=CC=CC=C1)N2C3=CC=CC=C3N=N2)C4=CC=CC=C4

Isomeric SMILES

CSC(=N[C@H](C1=CC=CC=C1)N2C3=CC=CC=C3N=N2)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4S/c1-26-21(17-12-6-3-7-13-17)22-20(16-10-4-2-5-11-16)25-19-15-9-8-14-18(19)23-24-25/h2-15,20H,1H3/t20-/m0/s1