2-(phenylcarbamoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(phenylcarbamoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid Openeye Name: 4-(4-isopropylphenyl)-2-(phenylcarbamoylamino)thiophene-3-carboxylic acid CAS Name: 2-[[anilino(oxo)methyl]amino]-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-(phenylcarbamoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid Traditional Name: 4-p-cumenyl-2-(phenylcarbamoylamino)-3-thenoic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-13(2)14-8-10-15(11-9-14)17-12-27-19(18(17)20(24)25)23-21(26)22-16-6-4-3-5-7-16/h3-13H,1-2H3,(H,24,25)(H2,22,23,26)