2-(2-sulfanylideneimidazolidin-1-yl)ethyl 1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate

Systemtic Name: 2-(2-sulfanylideneimidazolidin-1-yl)ethyl 1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate Openeye Name: 2-(2-thioxoimidazolidin-1-yl)ethyl 1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate CAS Name: 1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylic acid 2-(2-sulfanylidene-1-imidazolidinyl)ethyl ester IUPAC Name: 2-(2-sulfanylideneimidazolidin-1-yl)ethyl 1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate Traditional Name: 1,3,4,9-tetrahydro-$b-carboline-2-carboxylic acid 2-(2-thioxoimidazolidin-1-yl)ethyl ester Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C3=CC=CC=C3N2)C(=O)OCCN4CCNC4=S

Isomeric SMILES

C1CN(CC2=C1C3=CC=CC=C3N2)C(=O)OCCN4CCNC4=S

InChI

InChI=1S/C17H20N4O2S/c22-17(23-10-9-20-8-6-18-16(20)24)21-7-5-13-12-3-1-2-4-14(12)19-15(13)11-21/h1-4,19H,5-11H2,(H,18,24)