propyl 4-(thian-4-ylamino)benzoate

Systemtic Name: propyl 4-(thian-4-ylamino)benzoate Openeye Name: propyl 4-(tetrahydrothiopyran-4-ylamino)benzoate CAS Name: 4-(4-thianylamino)benzoic acid propyl ester IUPAC Name: propyl 4-(thian-4-ylamino)benzoate Traditional Name: 4-(tetrahydrothiopyran-4-ylamino)benzoic acid propyl ester Formula: C15H21NO2S MolecularWeight: 279.39774

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC2CCSCC2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC2CCSCC2

InChI

InChI=1S/C15H21NO2S/c1-2-9-18-15(17)12-3-5-13(6-4-12)16-14-7-10-19-11-8-14/h3-6,14,16H,2,7-11H2,1H3