[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl (Z)-2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H16N2O3S2 MolecularWeight: 408.49334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)C(=CC3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)/C(=C/C3=CC=CS3)/C4=CC=CS4

InChI

InChI=1S/C21H16N2O3S2/c1-14-6-2-3-8-16(14)20-22-19(26-23-20)13-25-21(24)17(18-9-5-11-28-18)12-15-7-4-10-27-15/h2-12H,13H2,1H3/b17-12+