methyl 3-azanyl-4-(2,4-dimethylphenyl)sulfonyl-5-piperidin-1-yl-thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-(2,4-dimethylphenyl)sulfonyl-5-piperidin-1-yl-thiophene-2-carboxylate Openeye Name: methyl 3-amino-4-(2,4-dimethylphenyl)sulfonyl-5-(1-piperidyl)thiophene-2-carboxylate CAS Name: 3-amino-4-(2,4-dimethylphenyl)sulfonyl-5-(1-piperidinyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-(2,4-dimethylphenyl)sulfonyl-5-piperidin-1-ylthiophene-2-carboxylate Traditional Name: 3-amino-4-(2,4-dimethylphenyl)sulfonyl-5-piperidino-thiophene-2-carboxylic acid methyl ester Formula: C19H24N2O4S2 MolecularWeight: 408.53486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)OC)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)OC)N3CCCCC3)C

InChI

InChI=1S/C19H24N2O4S2/c1-12-7-8-14(13(2)11-12)27(23,24)17-15(20)16(19(22)25-3)26-18(17)21-9-5-4-6-10-21/h7-8,11H,4-6,9-10,20H2,1-3H3