3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole

Systemtic Name: 3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole Openeye Name: 3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole CAS Name: 3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole IUPAC Name: 3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole Traditional Name: 3-(3-isothiocyanatopropyl)-5-methoxy-1H-indole Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCCN=C=S

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCCN=C=S

InChI

InChI=1S/C13H14N2OS/c1-16-11-4-5-13-12(7-11)10(8-15-13)3-2-6-14-9-17/h4-5,7-8,15H,2-3,6H2,1H3