4-(3-azanylpentan-3-yl)-3-methoxy-thioxanthen-9-one

Systemtic Name: 4-(3-azanylpentan-3-yl)-3-methoxy-thioxanthen-9-one Openeye Name: 4-(1-amino-1-ethyl-propyl)-3-methoxy-thioxanthen-9-one CAS Name: 4-(3-aminopentan-3-yl)-3-methoxy-9-thioxanthenone IUPAC Name: 4-(3-aminopentan-3-yl)-3-methoxythioxanthen-9-one Traditional Name: 4-(1-amino-1-ethyl-propyl)-3-methoxy-thioxanthen-9-one Formula: C19H21NO2S MolecularWeight: 327.44054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(C=CC2=C1SC3=CC=CC=C3C2=O)OC)N

Isomeric SMILES

CCC(CC)(C1=C(C=CC2=C1SC3=CC=CC=C3C2=O)OC)N

InChI

InChI=1S/C19H21NO2S/c1-4-19(20,5-2)16-14(22-3)11-10-13-17(21)12-8-6-7-9-15(12)23-18(13)16/h6-11H,4-5,20H2,1-3H3