4,5-dimethyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylic acid Openeye Name: 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]thiophene-3-carboxylic acid Traditional Name: 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-4,5-dimethyl-3-thenoic acid Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)C

InChI

InChI=1S/C20H24N2O3S/c1-11(2)14-8-7-9-15(10-14)20(5,6)22-19(25)21-17-16(18(23)24)12(3)13(4)26-17/h7-10H,1H2,2-6H3,(H,23,24)(H2,21,22,25)