methyl 2-[4-(4-methylphenoxy)butanoylamino]-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[4-(4-methylphenoxy)butanoylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[4-(4-methylphenoxy)butanoylamino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[4-(4-methylphenoxy)-1-oxobutyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-methylphenoxy)butanoylamino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[4-(4-methylphenoxy)butanoylamino]-4-(2-thienyl)thiophene-3-carboxylic acid methyl ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)NC2=C(C(=CS2)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)NC2=C(C(=CS2)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C21H21NO4S2/c1-14-7-9-15(10-8-14)26-11-3-6-18(23)22-20-19(21(24)25-2)16(13-28-20)17-5-4-12-27-17/h4-5,7-10,12-13H,3,6,11H2,1-2H3,(H,22,23)