ethyl 4-[[5-(4-methylpiperidin-1-yl)sulfonyl-1H-indol-2-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(4-methylpiperidin-1-yl)sulfonyl-1H-indol-2-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-[(4-methyl-1-piperidyl)sulfonyl]-1H-indole-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-[(4-methyl-1-piperidinyl)sulfonyl]-1H-indol-2-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-methylpiperidin-1-yl)sulfonyl-1H-indole-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-methylpiperidino)sulfonyl-1H-indole-2-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H30N4O5S MolecularWeight: 462.5624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(N2)C=CC(=C3)S(=O)(=O)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(N2)C=CC(=C3)S(=O)(=O)N4CCC(CC4)C

InChI

InChI=1S/C22H30N4O5S/c1-3-31-22(28)25-12-10-24(11-13-25)21(27)20-15-17-14-18(4-5-19(17)23-20)32(29,30)26-8-6-16(2)7-9-26/h4-5,14-16,23H,3,6-13H2,1-2H3