ethyl 6-methyl-2-[(5-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indole-5-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(5-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indole-5-carboxylate Openeye Name: ethyl 6-methyl-2-[[5-methyl-4-(1-piperidyl)-2-pyridyl]methylsulfanyl]-1H-indole-5-carboxylate CAS Name: 6-methyl-2-[[5-methyl-4-(1-piperidinyl)-2-pyridinyl]methylthio]-1H-indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(5-methyl-4-piperidin-1-ylpyridin-2-yl)methylsulfanyl]-1H-indole-5-carboxylate Traditional Name: 6-methyl-2-[(5-methyl-4-piperidino-2-pyridyl)methylthio]-1H-indole-5-carboxylic acid ethyl ester Formula: C24H29N3O2S MolecularWeight: 423.57096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=C1)C=C(N2)SCC3=NC=C(C(=C3)N4CCCCC4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=C1)C=C(N2)SCC3=NC=C(C(=C3)N4CCCCC4)C)C

InChI

InChI=1S/C24H29N3O2S/c1-4-29-24(28)20-11-18-12-23(26-21(18)10-16(20)2)30-15-19-13-22(17(3)14-25-19)27-8-6-5-7-9-27/h10-14,26H,4-9,15H2,1-3H3