[5-[(4-butan-2-ylphenyl)carbamoyl]-1,2,3-thiadiazol-4-yl]methyl ethyl carbonate

Systemtic Name: [5-[(4-butan-2-ylphenyl)carbamoyl]-1,2,3-thiadiazol-4-yl]methyl ethyl carbonate Openeye Name: ethyl [5-[(4-sec-butylphenyl)carbamoyl]thiadiazol-4-yl]methyl carbonate CAS Name: carbonic acid [5-[(4-butan-2-ylanilino)-oxomethyl]-4-thiadiazolyl]methyl ethyl ester IUPAC Name: [5-[(4-butan-2-ylphenyl)carbamoyl]thiadiazol-4-yl]methyl ethyl carbonate Traditional Name: carbonic acid ethyl [5-[(4-sec-butylphenyl)carbamoyl]thiadiazol-4-yl]methyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NS2)COC(=O)OCC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NS2)COC(=O)OCC

InChI

InChI=1S/C17H21N3O4S/c1-4-11(3)12-6-8-13(9-7-12)18-16(21)15-14(19-20-25-15)10-24-17(22)23-5-2/h6-9,11H,4-5,10H2,1-3H3,(H,18,21)