ethyl 5-[2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CC(=O)NC2=C(C=C(C=C2)Br)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CC(=O)NC2=C(C=C(C=C2)Br)C)C

InChI

InChI=1S/C20H24BrN3O4S/c1-5-28-20(27)19-13(3)9-18(29-19)23-17(26)11-24(4)10-16(25)22-15-7-6-14(21)8-12(15)2/h6-9H,5,10-11H2,1-4H3,(H,22,25)(H,23,26)