ethyl 3-[2-[methyl(thiophen-2-ylmethyl)amino]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[methyl(thiophen-2-ylmethyl)amino]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[methyl(2-thienylmethyl)amino]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[methyl(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[methyl(thiophen-2-ylmethyl)amino]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[methyl(2-thenyl)amino]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN(C)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN(C)CC3=CC=CS3

InChI

InChI=1S/C21H22N2O3S2/c1-3-26-21(25)20-17(12-18(28-20)15-8-5-4-6-9-15)22-19(24)14-23(2)13-16-10-7-11-27-16/h4-12H,3,13-14H2,1-2H3,(H,22,24)