propan-2-yl 2-(2-phenylsulfanylethanoylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-(2-phenylsulfanylethanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-oxo-2-(phenylthio)ethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(phenylthio)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S2/c1-12(2)24-18(23)13-8-9-15-16(10-13)26-19(20-15)21-17(22)11-25-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,20,21,22)