[1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: [1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: 1-[(4-isopropylphenyl)carbamoyl]propyl 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [1-oxo-1-(4-propan-2-ylanilino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(4-propan-2-ylanilino)butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid 1-(p-cumenylcarbamoyl)propyl ester Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C27H26N2O3S/c1-4-23(25(30)28-19-15-13-18(14-16-19)17(2)3)32-27(31)21-10-6-5-9-20(21)26-29-22-11-7-8-12-24(22)33-26/h5-17,23H,4H2,1-3H3,(H,28,30)