ethyl 2-[(3-pentoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[(3-pentoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(3-pentoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(3-pentoxyphenyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-pentoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-amoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H24N2O4S/c1-3-5-6-12-28-17-9-7-8-15(13-17)20(25)24-22-23-18-11-10-16(14-19(18)29-22)21(26)27-4-2/h7-11,13-14H,3-6,12H2,1-2H3,(H,23,24,25)