methyl 2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[(2-methoxy-3-dibenzofuranyl)amino]-sulfanylidenemethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2-methoxydibenzofuran-3-yl)thiocarbamoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C27H22N2O4S2 MolecularWeight: 502.60458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2O4S2/c1-15-23(16-9-5-4-6-10-16)24(26(30)32-3)25(35-15)29-27(34)28-19-14-21-18(13-22(19)31-2)17-11-7-8-12-20(17)33-21/h4-14H,1-3H3,(H2,28,29,34)