4-thiocyanatobut-2-ynyl N-phenylcarbamate

Systemtic Name: 4-thiocyanatobut-2-ynyl N-phenylcarbamate Openeye Name: 4-thiocyanatobut-2-ynyl N-phenylcarbamate CAS Name: N-phenylcarbamic acid 4-thiocyanatobut-2-ynyl ester IUPAC Name: 4-thiocyanatobut-2-ynyl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 4-thiocyanatobut-2-ynyl ester Formula: C12H10N2O2S MolecularWeight: 246.285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)OCC#CCSC#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)OCC#CCSC#N

InChI

InChI=1S/C12H10N2O2S/c13-10-17-9-5-4-8-16-12(15)14-11-6-2-1-3-7-11/h1-3,6-7H,8-9H2,(H,14,15)