butyl 2-[(3-butoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCCCC

InChI

InChI=1S/C23H26N2O4S/c1-3-5-12-28-18-9-7-8-16(14-18)21(26)25-23-24-19-11-10-17(15-20(19)30-23)22(27)29-13-6-4-2/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,24,25,26)