ethyl 4-phenyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylate Traditional Name: 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

InChI

InChI=1S/C26H28N2O3S/c1-6-31-24(29)22-21(18-11-8-7-9-12-18)16-32-23(22)27-25(30)28-26(4,5)20-14-10-13-19(15-20)17(2)3/h7-16H,2,6H2,1,3-5H3,(H2,27,28,30)