ethyl 5-chloranyl-3-phenylsulfanyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-phenylsulfanyl-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-phenylsulfanyl-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(phenylthio)-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-phenylsulfanyl-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(phenylthio)-1H-indole-2-carboxylic acid ethyl ester Formula: C17H14ClNO2S MolecularWeight: 331.81656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SC3=CC=CC=C3

InChI

InChI=1S/C17H14ClNO2S/c1-2-21-17(20)15-16(22-12-6-4-3-5-7-12)13-10-11(18)8-9-14(13)19-15/h3-10,19H,2H2,1H3