N-(1H-indol-3-ylmethyl)-2-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]sulfanyl-ethanamine

Systemtic Name: N-(1H-indol-3-ylmethyl)-2-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]sulfanyl-ethanamine Openeye Name: N-(1H-indol-3-ylmethyl)-2-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridyl]sulfanyl]ethanamine CAS Name: N-(1H-indol-3-ylmethyl)-2-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridinyl]thio]ethanamine IUPAC Name: N-(1H-indol-3-ylmethyl)-2-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]sulfanylethanamine Traditional Name: 1H-indol-3-ylmethyl-[2-[[5-(3-methyl-2H-indazol-5-yl)-3-pyridyl]thio]ethyl]amine Formula: C24H23N5S MolecularWeight: 413.53792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NN1)C3=CC(=CN=C3)SCCNCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=C2C=C(C=CC2=NN1)C3=CC(=CN=C3)SCCNCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C24H23N5S/c1-16-22-11-17(6-7-24(22)29-28-16)18-10-20(15-26-12-18)30-9-8-25-13-19-14-27-23-5-3-2-4-21(19)23/h2-7,10-12,14-15,25,27H,8-9,13H2,1H3,(H,28,29)