ethyl 5-chloranyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylcarbamoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylcarbamoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-chloro-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylcarbamoylamino]thiophene-3-carboxylate CAS Name: 5-chloro-2-[[[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethylamino]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylcarbamoylamino]thiophene-3-carboxylate Traditional Name: 5-chloro-2-[2-[4-(2-methoxyphenyl)piperazino]ethylcarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C21H27ClN4O4S MolecularWeight: 466.98148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)Cl)NC(=O)NCCN2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)Cl)NC(=O)NCCN2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H27ClN4O4S/c1-3-30-20(27)15-14-18(22)31-19(15)24-21(28)23-8-9-25-10-12-26(13-11-25)16-6-4-5-7-17(16)29-2/h4-7,14H,3,8-13H2,1-2H3,(H2,23,24,28)