ethyl 4-[2,2-dimethyl-4-(5-methylthiophen-2-yl)benzo[g]thiochromen-7-yl]benzoate

Systemtic Name: ethyl 4-[2,2-dimethyl-4-(5-methylthiophen-2-yl)benzo[g]thiochromen-7-yl]benzoate Openeye Name: ethyl 4-[2,2-dimethyl-4-(5-methyl-2-thienyl)benzo[g]thiochromen-7-yl]benzoate CAS Name: 4-[2,2-dimethyl-4-(5-methyl-2-thiophenyl)-7-benzo[g]thiochromenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,2-dimethyl-4-(5-methylthiophen-2-yl)benzo[g]thiochromen-7-yl]benzoate Traditional Name: 4-[2,2-dimethyl-4-(5-methyl-2-thienyl)benzo[g]thiochromen-7-yl]benzoic acid ethyl ester Formula: C29H26O2S2 MolecularWeight: 470.64554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC3=CC4=C(C=C3C=C2)SC(C=C4C5=CC=C(S5)C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC3=CC4=C(C=C3C=C2)SC(C=C4C5=CC=C(S5)C)(C)C

InChI

InChI=1S/C29H26O2S2/c1-5-31-28(30)20-9-7-19(8-10-20)21-11-12-22-16-27-24(15-23(22)14-21)25(17-29(3,4)33-27)26-13-6-18(2)32-26/h6-17H,5H2,1-4H3