methyl (2R)-2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enimidothioate

Systemtic Name: methyl (2R)-2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enimidothioate Openeye Name: methyl (2R)-2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enimidothioate CAS Name: (2R)-2-(1-benzotriazolyl)-2-ethoxy-N-phenyl-3-butenimidothioic acid methyl ester IUPAC Name: methyl (2R)-2-(benzotriazol-1-yl)-2-ethoxy-N-phenylbut-3-enimidothioate Traditional Name: (2R)-2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enimidothioic acid methyl ester Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C=C)(C(=NC1=CC=CC=C1)SC)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCO[C@](C=C)(C(=NC1=CC=CC=C1)SC)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H20N4OS/c1-4-19(24-5-2,18(25-3)20-15-11-7-6-8-12-15)23-17-14-10-9-13-16(17)21-22-23/h4,6-14H,1,5H2,2-3H3/t19-/m1/s1