methyl (E)-2-cyano-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(2-morpholino-4-phenyl-thiazol-5-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-morpholino-4-phenyl-thiazol-5-yl)acrylic acid methyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(N=C(S1)N2CCOCC2)C3=CC=CC=C3)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=C(N=C(S1)N2CCOCC2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C18H17N3O3S/c1-23-17(22)14(12-19)11-15-16(13-5-3-2-4-6-13)20-18(25-15)21-7-9-24-10-8-21/h2-6,11H,7-10H2,1H3/b14-11+