methyl 4-cyano-5-[[5-(3,4-dimethylphenyl)furan-2-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-[[5-(3,4-dimethylphenyl)furan-2-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[[5-(3,4-dimethylphenyl)furan-2-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[[5-(3,4-dimethylphenyl)-2-furanyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[[5-(3,4-dimethylphenyl)furan-2-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[5-(3,4-dimethylphenyl)-2-furoyl]amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC3=C(C(=C(S3)C(=O)OC)C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC3=C(C(=C(S3)C(=O)OC)C)C#N)C

InChI

InChI=1S/C21H18N2O4S/c1-11-5-6-14(9-12(11)2)16-7-8-17(27-16)19(24)23-20-15(10-22)13(3)18(28-20)21(25)26-4/h5-9H,1-4H3,(H,23,24)