8-pyridin-3-yl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isothiochromene-5-carbonitrile

Systemtic Name: 8-pyridin-3-yl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isothiochromene-5-carbonitrile Openeye Name: 8-(3-pyridyl)-6-pyrrolidin-1-yl-isothiochromane-5-carbonitrile CAS Name: 8-(3-pyridinyl)-6-(1-pyrrolidinyl)-3,4-dihydro-1H-2-benzothiopyran-5-carbonitrile IUPAC Name: 8-pyridin-3-yl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isothiochromene-5-carbonitrile Traditional Name: 8-(3-pyridyl)-6-pyrrolidino-isothiochroman-5-carbonitrile Formula: C19H19N3S MolecularWeight: 321.43926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C3=C(CSCC3)C(=C2)C4=CN=CC=C4)C#N

Isomeric SMILES

C1CCN(C1)C2=C(C3=C(CSCC3)C(=C2)C4=CN=CC=C4)C#N

InChI

InChI=1S/C19H19N3S/c20-11-17-15-5-9-23-13-18(15)16(14-4-3-6-21-12-14)10-19(17)22-7-1-2-8-22/h3-4,6,10,12H,1-2,5,7-9,13H2