N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-3,4-dihydro-1H-isothiochromen-4-amine

Systemtic Name: N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-3,4-dihydro-1H-isothiochromen-4-amine Openeye Name: N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]isothiochroman-4-amine CAS Name: N-[1-(1,5-dimethyl-4-pyrazolyl)ethyl]-3,4-dihydro-1H-2-benzothiopyran-4-amine IUPAC Name: N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-3,4-dihydro-1H-isothiochromen-4-amine Traditional Name: 1-(1,5-dimethylpyrazol-4-yl)ethyl-isothiochroman-4-yl-amine Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(C)NC2CSCC3=CC=CC=C23

Isomeric SMILES

CC1=C(C=NN1C)C(C)NC2CSCC3=CC=CC=C23

InChI

InChI=1S/C16H21N3S/c1-11(15-8-17-19(3)12(15)2)18-16-10-20-9-13-6-4-5-7-14(13)16/h4-8,11,16,18H,9-10H2,1-3H3