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

Systemtic Name: ethyl 2-[(3-butan-2-yloxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(3-sec-butoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(3-butan-2-yloxyphenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-butan-2-yloxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-sec-butoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC

InChI

InChI=1S/C21H22N2O4S/c1-4-13(3)27-16-8-6-7-14(11-16)19(24)23-21-22-17-10-9-15(12-18(17)28-21)20(25)26-5-2/h6-13H,4-5H2,1-3H3,(H,22,23,24)