[1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: [1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: 1-[(2-methoxycarbonylphenyl)carbamoyl]propyl 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid 1-[(2-carbomethoxyphenyl)carbamoyl]propyl ester Formula: C26H22N2O5S MolecularWeight: 474.52828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C26H22N2O5S/c1-3-21(23(29)27-19-13-7-6-12-18(19)25(30)32-2)33-26(31)17-11-5-4-10-16(17)24-28-20-14-8-9-15-22(20)34-24/h4-15,21H,3H2,1-2H3,(H,27,29)