methyl 5-(dimethylcarbamoyl)-2-[2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-2-[2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-2-[[2-[4-(2-furylmethyl)piperazin-1-yl]acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-[[2-[4-(2-furanylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-2-[[2-[4-(furan-2-ylmethyl)piperazin-1-yl]acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[[2-[4-(2-furfuryl)piperazino]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)CC3=CC=CO3)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)CC3=CC=CO3)C(=O)N(C)C

InChI

InChI=1S/C21H28N4O5S/c1-14-17(21(28)29-4)19(31-18(14)20(27)23(2)3)22-16(26)13-25-9-7-24(8-10-25)12-15-6-5-11-30-15/h5-6,11H,7-10,12-13H2,1-4H3,(H,22,26)