(E)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-morpholino-4-phenyl-thiazol-5-yl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(2-morpholino-4-phenyl-thiazol-5-yl)-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C21H22N4O2S/c22-15-17(20(26)24-8-4-5-9-24)14-18-19(16-6-2-1-3-7-16)23-21(28-18)25-10-12-27-13-11-25/h1-3,6-7,14H,4-5,8-13H2/b17-14+