butyl 2-[(1-phenylcyclopentyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[(1-phenylcyclopentyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[(1-phenylcyclopentanecarbonyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(1-phenylcyclopentyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[(1-phenylcyclopentanecarbonyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(1-phenylcyclopentanecarbonyl)amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3S/c1-2-3-15-29-21(27)17-11-12-19-20(16-17)30-23(25-19)26-22(28)24(13-7-8-14-24)18-9-5-4-6-10-18/h4-6,9-12,16H,2-3,7-8,13-15H2,1H3,(H,25,26,28)