ethyl 5-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[4-(4-hydroxyphenyl)piperazino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)O)C

InChI

InChI=1S/C20H25N3O4S/c1-3-27-20(26)19-14(2)12-18(28-19)21-17(25)13-22-8-10-23(11-9-22)15-4-6-16(24)7-5-15/h4-7,12,24H,3,8-11,13H2,1-2H3,(H,21,25)