6-(2-azanylpropyl)-2-methyl-thioxanthen-9-one

Systemtic Name: 6-(2-azanylpropyl)-2-methyl-thioxanthen-9-one Openeye Name: 6-(2-aminopropyl)-2-methyl-thioxanthen-9-one CAS Name: 6-(2-aminopropyl)-2-methyl-9-thioxanthenone IUPAC Name: 6-(2-aminopropyl)-2-methylthioxanthen-9-one Traditional Name: 6-(2-aminopropyl)-2-methyl-thioxanthen-9-one Formula: C17H17NOS MolecularWeight: 283.38798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)CC(C)N

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C2=O)C=CC(=C3)CC(C)N

InChI

InChI=1S/C17H17NOS/c1-10-3-6-15-14(7-10)17(19)13-5-4-12(8-11(2)18)9-16(13)20-15/h3-7,9,11H,8,18H2,1-2H3