ethyl 2-[2-[2-(4-chloranylphenoxy)ethyl-methyl-amino]ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-(4-chloranylphenoxy)ethyl-methyl-amino]ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-(4-chlorophenoxy)ethyl-methyl-amino]acetyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-(4-chlorophenoxy)ethyl-methylamino]-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(4-chlorophenoxy)ethyl-methylamino]acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-(4-chlorophenoxy)ethyl-methyl-amino]acetyl]amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H27ClN2O4S MolecularWeight: 438.96808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CN(C)CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CN(C)CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H27ClN2O4S/c1-5-27-21(26)17-12-18(14(2)3)29-20(17)23-19(25)13-24(4)10-11-28-16-8-6-15(22)7-9-16/h6-9,12,14H,5,10-11,13H2,1-4H3,(H,23,25)