methyl (E)-3-[3-[4-(6-morpholin-4-yl-4-oxidanylidene-thiopyran-2-yl)phenyl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-[4-(6-morpholin-4-yl-4-oxidanylidene-thiopyran-2-yl)phenyl]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[4-(6-morpholino-4-oxo-thiopyran-2-yl)phenyl]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[4-[6-(4-morpholinyl)-4-oxo-2-thiopyranyl]phenyl]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[4-(6-morpholin-4-yl-4-oxothiopyran-2-yl)phenyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[4-(4-keto-6-morpholino-thiopyran-2-yl)phenyl]phenyl]acrylic acid methyl ester Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=CC(=C1)C2=CC=C(C=C2)C3=CC(=O)C=C(S3)N4CCOCC4

Isomeric SMILES

COC(=O)/C=C/C1=CC=CC(=C1)C2=CC=C(C=C2)C3=CC(=O)C=C(S3)N4CCOCC4

InChI

InChI=1S/C25H23NO4S/c1-29-25(28)10-5-18-3-2-4-21(15-18)19-6-8-20(9-7-19)23-16-22(27)17-24(31-23)26-11-13-30-14-12-26/h2-10,15-17H,11-14H2,1H3/b10-5+