[4-[(2-methoxyphenyl)carbonylamino]phenyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [4-[(2-methoxyphenyl)carbonylamino]phenyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [4-[(2-methoxybenzoyl)amino]phenyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [4-[[(2-methoxyphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(2-methoxybenzoyl)amino]phenyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [4-(o-anisoylamino)phenyl] ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H22N2O4S/c1-30-21-9-4-2-7-19(21)25(29)26-17-13-15-18(16-14-17)31-24(28)12-6-11-23-27-20-8-3-5-10-22(20)32-23/h2-5,7-10,13-16H,6,11-12H2,1H3,(H,26,29)