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

Systemtic Name: propan-2-yl 2-[(3-phenylmethoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[(3-benzyloxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(3-phenylmethoxyphenyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-phenylmethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-benzoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S/c1-16(2)31-24(29)19-11-12-21-22(14-19)32-25(26-21)27-23(28)18-9-6-10-20(13-18)30-15-17-7-4-3-5-8-17/h3-14,16H,15H2,1-2H3,(H,26,27,28)