tert-butyl 2-chloranyl-5-(propan-2-yloxycarbothioylamino)benzoate

Systemtic Name: tert-butyl 2-chloranyl-5-(propan-2-yloxycarbothioylamino)benzoate Openeye Name: tert-butyl 2-chloro-5-(isopropoxycarbothioylamino)benzoate CAS Name: 2-chloro-5-[[propan-2-yloxy(sulfanylidene)methyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-chloro-5-(propan-2-yloxycarbothioylamino)benzoate Traditional Name: 2-chloro-5-(isopropoxycarbothioylamino)benzoic acid tert-butyl ester Formula: C15H20ClNO3S MolecularWeight: 329.8422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H20ClNO3S/c1-9(2)19-14(21)17-10-6-7-12(16)11(8-10)13(18)20-15(3,4)5/h6-9H,1-5H3,(H,17,21)