(Z)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-(1-methylpyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (Z)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-(1-methylpyrazol-4-yl)prop-2-enenitrile Openeye Name: (Z)-2-[4-(1-adamantyl)thiazol-2-yl]-3-(1-methylpyrazol-4-yl)prop-2-enenitrile CAS Name: (Z)-2-[4-(1-adamantyl)-2-thiazolyl]-3-(1-methyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (Z)-2-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-(1-methylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (Z)-2-[4-(1-adamantyl)thiazol-2-yl]-3-(1-methylpyrazol-4-yl)acrylonitrile Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=C(C#N)C2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C=C(C=N1)/C=C(/C#N)\C2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H22N4S/c1-24-11-16(10-22-24)5-17(9-21)19-23-18(12-25-19)20-6-13-2-14(7-20)4-15(3-13)8-20/h5,10-15H,2-4,6-8H2,1H3/b17-5-