4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-ethylsulfanyl-6-methyl-pyridine-3-carboxamide

Systemtic Name: 4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-ethylsulfanyl-6-methyl-pyridine-3-carboxamide Openeye Name: 4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-ethylsulfanyl-6-methyl-pyridine-3-carboxamide CAS Name: 4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-(ethylthio)-6-methyl-3-pyridinecarboxamide IUPAC Name: 4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-ethylsulfanyl-6-methylpyridine-3-carboxamide Traditional Name: 4-(1,4-diazabicyclo[2.2.0]hexan-3-yl)-1H-indole; 2-(ethylthio)-6-methyl-nicotinamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC(=N1)C)C(=O)N.C1CN2N1CC2C3=C4C=CNC4=CC=C3

Isomeric SMILES

CCSC1=C(C=CC(=N1)C)C(=O)N.C1CN2N1CC2C3=C4C=CNC4=CC=C3

InChI

InChI=1S/C12H13N3.C9H12N2OS/c1-2-10(9-4-5-13-11(9)3-1)12-8-14-6-7-15(12)14;1-3-13-9-7(8(10)12)5-4-6(2)11-9/h1-5,12-13H,6-8H2;4-5H,3H2,1-2H3,(H2,10,12)