[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate

Systemtic Name: [2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate Openeye Name: [2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-propyl-2-thiophenecarboxylic acid [2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl] 5-methyl-4-propylthiophene-2-carboxylate Traditional Name: 5-methyl-4-propyl-thiophene-2-carboxylic acid [2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl] ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C22H28N2O4S/c1-4-7-17-14-20(29-16(17)2)22(26)28-15-21(25)24-12-10-23(11-13-24)18-8-5-6-9-19(18)27-3/h5-6,8-9,14H,4,7,10-13,15H2,1-3H3