methyl 5-(bromomethyl)-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-(bromomethyl)-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-(bromomethyl)-3-(p-tolylcarbamoylamino)thiophene-2-carboxylate CAS Name: 5-(bromomethyl)-3-[[(4-methylanilino)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(bromomethyl)-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-(bromomethyl)-3-(p-tolylcarbamoylamino)thiophene-2-carboxylic acid methyl ester Formula: C15H15BrN2O3S MolecularWeight: 383.2602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=C(SC(=C2)CBr)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=C(SC(=C2)CBr)C(=O)OC

InChI

InChI=1S/C15H15BrN2O3S/c1-9-3-5-10(6-4-9)17-15(20)18-12-7-11(8-16)22-13(12)14(19)21-2/h3-7H,8H2,1-2H3,(H2,17,18,20)