N-(3,4-dihydro-1H-isothiochromen-4-yl)-1-ethyl-pyrazol-4-amine

Systemtic Name: N-(3,4-dihydro-1H-isothiochromen-4-yl)-1-ethyl-pyrazol-4-amine Openeye Name: 1-ethyl-N-isothiochroman-4-yl-pyrazol-4-amine CAS Name: N-(3,4-dihydro-1H-2-benzothiopyran-4-yl)-1-ethyl-4-pyrazolamine IUPAC Name: N-(3,4-dihydro-1H-isothiochromen-4-yl)-1-ethylpyrazol-4-amine Traditional Name: (1-ethylpyrazol-4-yl)-isothiochroman-4-yl-amine Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC2CSCC3=CC=CC=C23

Isomeric SMILES

CCN1C=C(C=N1)NC2CSCC3=CC=CC=C23

InChI

InChI=1S/C14H17N3S/c1-2-17-8-12(7-15-17)16-14-10-18-9-11-5-3-4-6-13(11)14/h3-8,14,16H,2,9-10H2,1H3