methyl 1-ethylsulfonyl-5-[ethylsulfonyl(thiophen-2-ylcarbonyl)amino]-2-methyl-indole-3-carboxylate

Systemtic Name: methyl 1-ethylsulfonyl-5-[ethylsulfonyl(thiophen-2-ylcarbonyl)amino]-2-methyl-indole-3-carboxylate Openeye Name: methyl 1-ethylsulfonyl-5-[ethylsulfonyl(thiophene-2-carbonyl)amino]-2-methyl-indole-3-carboxylate CAS Name: 1-ethylsulfonyl-5-[ethylsulfonyl-[oxo(thiophen-2-yl)methyl]amino]-2-methyl-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethylsulfonyl-5-[ethylsulfonyl(thiophene-2-carbonyl)amino]-2-methylindole-3-carboxylate Traditional Name: 1-esyl-5-[esyl(2-thenoyl)amino]-2-methyl-indole-3-carboxylic acid methyl ester Formula: C20H22N2O7S3 MolecularWeight: 498.59288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)N(C(=O)C3=CC=CS3)S(=O)(=O)CC)C(=O)OC)C

Isomeric SMILES

CCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)N(C(=O)C3=CC=CS3)S(=O)(=O)CC)C(=O)OC)C

InChI

InChI=1S/C20H22N2O7S3/c1-5-31(25,26)21-13(3)18(20(24)29-4)15-12-14(9-10-16(15)21)22(32(27,28)6-2)19(23)17-8-7-11-30-17/h7-12H,5-6H2,1-4H3