methyl 4-(3-chlorophenyl)-5-methyl-2-(3-methylbut-2-enoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(3-chlorophenyl)-5-methyl-2-(3-methylbut-2-enoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(3-chlorophenyl)-5-methyl-2-(3-methylbut-2-enoylamino)thiophene-3-carboxylate CAS Name: 4-(3-chlorophenyl)-5-methyl-2-[(3-methyl-1-oxobut-2-enyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-chlorophenyl)-5-methyl-2-(3-methylbut-2-enoylamino)thiophene-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-5-methyl-2-(3-methylbut-2-enoylamino)thiophene-3-carboxylic acid methyl ester Formula: C18H18ClNO3S MolecularWeight: 363.85842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C=C(C)C)C(=O)OC)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C=C(C)C)C(=O)OC)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H18ClNO3S/c1-10(2)8-14(21)20-17-16(18(22)23-4)15(11(3)24-17)12-6-5-7-13(19)9-12/h5-9H,1-4H3,(H,20,21)