ethyl 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-2-phenylethenyl]quinolin-4-yl]ethanoate

Systemtic Name: ethyl 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-2-phenylethenyl]quinolin-4-yl]ethanoate Openeye Name: ethyl 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-styryl]-4-quinolyl]acetate CAS Name: 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-2-phenylethenyl]-4-quinolinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-2-phenylethenyl]quinolin-4-yl]acetate Traditional Name: 2-(1,3-dithian-2-ylidene)-2-[6-methyl-2-[(E)-styryl]-4-quinolyl]acetic acid ethyl ester Formula: C26H25NO2S2 MolecularWeight: 447.6122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SCCCS1)C2=CC(=NC3=C2C=C(C=C3)C)C=CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(=C1SCCCS1)C2=CC(=NC3=C2C=C(C=C3)C)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H25NO2S2/c1-3-29-25(28)24(26-30-14-7-15-31-26)22-17-20(12-11-19-8-5-4-6-9-19)27-23-13-10-18(2)16-21(22)23/h4-6,8-13,16-17H,3,7,14-15H2,1-2H3/b12-11+