ethyl 3-methyl-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-2-carboxylate Traditional Name: 5-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)C

InChI

InChI=1S/C21H26N2O3S/c1-7-26-19(24)18-14(4)11-17(27-18)22-20(25)23-21(5,6)16-10-8-9-15(12-16)13(2)3/h8-12H,2,7H2,1,3-6H3,(H2,22,23,25)