4-oxidanylidene-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-2,3-dihydrothiochromene-8-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-2,3-dihydrothiochromene-8-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-4-oxo-thiochromane-8-carboxamide CAS Name: 4-oxo-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-2,3-dihydro-1-benzothiopyran-8-carboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-4-oxo-2,3-dihydrothiochromene-8-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-4-keto-thiochroman-8-carboxamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)C1=CC=CC2=C1SCCC2=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CCCNC(=O)C1=CC=CC2=C1SCCC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S/c1-17(2)25(16-18-8-4-3-5-9-18)14-7-13-24-23(27)20-11-6-10-19-21(26)12-15-28-22(19)20/h3-6,8-11,17H,7,12-16H2,1-2H3,(H,24,27)