(E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-pyridin-4-yl-prop-2-enenitrile

Systemtic Name: (E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-pyridin-4-yl-prop-2-enenitrile Openeye Name: (E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-(4-pyridyl)prop-2-enenitrile CAS Name: (E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-pyridin-4-yl-2-propenenitrile IUPAC Name: (E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-pyridin-4-ylprop-2-enenitrile Traditional Name: (E)-2-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-(4-pyridyl)acrylonitrile Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)C(=CC3=CC=NC=C3)C#N

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=N2)/C(=C/C3=CC=NC=C3)/C#N

InChI

InChI=1S/C16H15N3S/c1-11-2-3-14-15(8-11)20-16(19-14)13(10-17)9-12-4-6-18-7-5-12/h4-7,9,11H,2-3,8H2,1H3/b13-9+/t11-/m0/s1