propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-(phenylcarbamoylamino)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-(phenylcarbamoylamino)thiophene-3-carboxylate Openeye Name: isopropyl 5-(diethylcarbamoyl)-4-methyl-2-(phenylcarbamoylamino)thiophene-3-carboxylate CAS Name: 2-[[anilino(oxo)methyl]amino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-(phenylcarbamoylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-4-methyl-2-(phenylcarbamoylamino)thiophene-3-carboxylic acid isopropyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)NC2=CC=CC=C2)C(=O)OC(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)NC2=CC=CC=C2)C(=O)OC(C)C)C

InChI

InChI=1S/C21H27N3O4S/c1-6-24(7-2)19(25)17-14(5)16(20(26)28-13(3)4)18(29-17)23-21(27)22-15-11-9-8-10-12-15/h8-13H,6-7H2,1-5H3,(H2,22,23,27)