butyl 2-[[4-(2-methylpropoxy)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[[4-(2-methylpropoxy)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[(4-isobutoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[4-(2-methylpropoxy)benzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(4-isobutoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)OCC(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)OCC(C)C

InChI

InChI=1S/C23H26N2O4S/c1-4-5-12-28-22(27)17-8-11-19-20(13-17)30-23(24-19)25-21(26)16-6-9-18(10-7-16)29-14-15(2)3/h6-11,13,15H,4-5,12,14H2,1-3H3,(H,24,25,26)