5-(4-methyl-1,2-oxazol-5-yl)-N,N-dipropyl-3,4-dihydro-2H-thiochromen-3-amine

Systemtic Name: 5-(4-methyl-1,2-oxazol-5-yl)-N,N-dipropyl-3,4-dihydro-2H-thiochromen-3-amine Openeye Name: 5-(4-methylisoxazol-5-yl)-N,N-dipropyl-thiochroman-3-amine CAS Name: 5-(4-methyl-5-isoxazolyl)-N,N-dipropyl-3,4-dihydro-2H-1-benzothiopyran-3-amine IUPAC Name: 5-(4-methyl-1,2-oxazol-5-yl)-N,N-dipropyl-3,4-dihydro-2H-thiochromen-3-amine Traditional Name: [5-(4-methylisoxazol-5-yl)thiochroman-3-yl]-dipropyl-amine Formula: C19H26N2OS MolecularWeight: 330.48754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1CC2=C(C=CC=C2SC1)C3=C(C=NO3)C

Isomeric SMILES

CCCN(CCC)C1CC2=C(C=CC=C2SC1)C3=C(C=NO3)C

InChI

InChI=1S/C19H26N2OS/c1-4-9-21(10-5-2)15-11-17-16(19-14(3)12-20-22-19)7-6-8-18(17)23-13-15/h6-8,12,15H,4-5,9-11,13H2,1-3H3