S-(phenylmethyl) N-(2-phenyl-1,3-benzoxazol-5-yl)carbamothioate

Systemtic Name: S-(phenylmethyl) N-(2-phenyl-1,3-benzoxazol-5-yl)carbamothioate Openeye Name: S-benzyl N-(2-phenyl-1,3-benzoxazol-5-yl)carbamothioate CAS Name: N-(2-phenyl-1,3-benzoxazol-5-yl)carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-(2-phenyl-1,3-benzoxazol-5-yl)carbamothioate Traditional Name: N-(2-phenyl-1,3-benzoxazol-5-yl)thiocarbamic acid S-benzyl ester Formula: C21H16N2O2S MolecularWeight: 360.42894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O2S/c24-21(26-14-15-7-3-1-4-8-15)22-17-11-12-19-18(13-17)23-20(25-19)16-9-5-2-6-10-16/h1-13H,14H2,(H,22,24)