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2-(5-methoxy-1H-indol-3-yl)ethyl carbamimidothioate

2-(5-methoxy-1H-indol-3-yl)ethyl carbamimidothioate

Systemtic Name:2-(5-methoxy-1H-indol-3-yl)ethyl carbamimidothioate
Openeye Name:2-[2-(5-methoxy-1H-indol-3-yl)ethyl]isothiourea
CAS Name:carbamimidothioic acid 2-(5-methoxy-1H-indol-3-yl)ethyl ester
IUPAC Name:2-(5-methoxy-1H-indol-3-yl)ethyl carbamimidothioate
Traditional Name:2-[2-(5-methoxy-1H-indol-3-yl)ethyl]isothiourea
Formula: C12H15N3OS
MolecularWeight: 249.332
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCSC(=N)N


Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCSC(=N)N


InChI

InChI=1S/C12H15N3OS/c1-16-9-2-3-11-10(6-9)8(7-15-11)4-5-17-12(13)14/h2-3,6-7,15H,4-5H2,1H3,(H3,13,14)


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