N-[4-[[4-(5-nitro-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]propanamide

Systemtic Name: N-[4-[[4-(5-nitro-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]propanamide Openeye Name: N-[4-[[4-(5-nitro-1H-indol-3-yl)-1-piperidyl]methyl]thiazol-2-yl]propanamide CAS Name: N-[4-[[4-(5-nitro-1H-indol-3-yl)-1-piperidinyl]methyl]-2-thiazolyl]propanamide IUPAC Name: N-[4-[[4-(5-nitro-1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]propanamide Traditional Name: N-[4-[[4-(5-nitro-1H-indol-3-yl)piperidino]methyl]thiazol-2-yl]propionamide Formula: C20H23N5O3S MolecularWeight: 413.49332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=CS1)CN2CCC(CC2)C3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=NC(=CS1)CN2CCC(CC2)C3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O3S/c1-2-19(26)23-20-22-14(12-29-20)11-24-7-5-13(6-8-24)17-10-21-18-4-3-15(25(27)28)9-16(17)18/h3-4,9-10,12-13,21H,2,5-8,11H2,1H3,(H,22,23,26)