tert-butyl N-[(E)-[phenyl-(3-phenyl-1,2-thiazol-5-yl)methylidene]amino]carbamate

Systemtic Name: tert-butyl N-[(E)-[phenyl-(3-phenyl-1,2-thiazol-5-yl)methylidene]amino]carbamate Openeye Name: tert-butyl N-[(E)-[phenyl-(3-phenylisothiazol-5-yl)methylene]amino]carbamate CAS Name: N-[(E)-[phenyl-(3-phenyl-5-isothiazolyl)methylidene]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-[phenyl-(3-phenyl-1,2-thiazol-5-yl)methylidene]amino]carbamate Traditional Name: N-[(E)-[phenyl-(3-phenylisothiazol-5-yl)methylene]amino]carbamic acid tert-butyl ester Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN=C(C1=CC=CC=C1)C2=CC(=NS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N/N=C(\C1=CC=CC=C1)/C2=CC(=NS2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-21(2,3)26-20(25)23-22-19(16-12-8-5-9-13-16)18-14-17(24-27-18)15-10-6-4-7-11-15/h4-14H,1-3H3,(H,23,25)/b22-19+