N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyrazol-1-yl-propanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyrazol-1-yl-propanamide Openeye Name: 2-pyrazol-1-yl-N-thiochroman-4-yl-propanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(1-pyrazolyl)propanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-pyrazol-1-ylpropanamide Traditional Name: 2-pyrazol-1-yl-N-thiochroman-4-yl-propionamide Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=CC=CC=C12)N3C=CC=N3

Isomeric SMILES

CC(C(=O)NC1CCSC2=CC=CC=C12)N3C=CC=N3

InChI

InChI=1S/C15H17N3OS/c1-11(18-9-4-8-16-18)15(19)17-13-7-10-20-14-6-3-2-5-12(13)14/h2-6,8-9,11,13H,7,10H2,1H3,(H,17,19)