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

Systemtic Name: (E)-2-(3-methylphenyl)carbonyl-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enenitrile Openeye Name: (E)-2-(3-methylbenzoyl)-3-(2-morpholino-4-phenyl-thiazol-5-yl)prop-2-enenitrile CAS Name: (E)-2-[(3-methylphenyl)-oxomethyl]-3-[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]-2-propenenitrile IUPAC Name: (E)-2-(3-methylbenzoyl)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-morpholino-4-phenyl-thiazol-5-yl)-2-m-toluoyl-acrylonitrile Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=CC2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C/C2=C(N=C(S2)N3CCOCC3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C24H21N3O2S/c1-17-6-5-9-19(14-17)23(28)20(16-25)15-21-22(18-7-3-2-4-8-18)26-24(30-21)27-10-12-29-13-11-27/h2-9,14-15H,10-13H2,1H3/b20-15+