propan-2-yl 2-[(3-propoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[(3-propoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[(3-propoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(3-propoxyphenyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-propoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-propoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C21H22N2O4S/c1-4-10-26-16-7-5-6-14(11-16)19(24)23-21-22-17-9-8-15(12-18(17)28-21)20(25)27-13(2)3/h5-9,11-13H,4,10H2,1-3H3,(H,22,23,24)