N-[2-(4-methylsulfanylphenyl)ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

Systemtic Name: N-[2-(4-methylsulfanylphenyl)ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide Openeye Name: N-[2-(4-methylsulfanylphenyl)ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide CAS Name: N-[2-[4-(methylthio)phenyl]ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide IUPAC Name: N-[2-(4-methylsulfanylphenyl)ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide Traditional Name: N-[2-[4-(methylthio)phenyl]ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide Formula: C21H19N3OS MolecularWeight: 361.46006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(N2)C4=C(C=CC=N4)C=C3

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(N2)C4=C(C=CC=N4)C=C3

InChI

InChI=1S/C21H19N3OS/c1-26-17-8-4-14(5-9-17)10-12-23-21(25)18-13-16-7-6-15-3-2-11-22-19(15)20(16)24-18/h2-9,11,13,24H,10,12H2,1H3,(H,23,25)