1-methoxy-6-[(5-methylfuran-2-yl)methylamino]thioxanthen-9-one

Systemtic Name: 1-methoxy-6-[(5-methylfuran-2-yl)methylamino]thioxanthen-9-one Openeye Name: 1-methoxy-6-[(5-methyl-2-furyl)methylamino]thioxanthen-9-one CAS Name: 1-methoxy-6-[(5-methyl-2-furanyl)methylamino]-9-thioxanthenone IUPAC Name: 1-methoxy-6-[(5-methylfuran-2-yl)methylamino]thioxanthen-9-one Traditional Name: 1-methoxy-6-[(5-methyl-2-furyl)methylamino]thioxanthen-9-one Formula: C20H17NO3S MolecularWeight: 351.41888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=CC3=C(C=C2)C(=O)C4=C(C=CC=C4S3)OC

Isomeric SMILES

CC1=CC=C(O1)CNC2=CC3=C(C=C2)C(=O)C4=C(C=CC=C4S3)OC

InChI

InChI=1S/C20H17NO3S/c1-12-6-8-14(24-12)11-21-13-7-9-15-18(10-13)25-17-5-3-4-16(23-2)19(17)20(15)22/h3-10,21H,11H2,1-2H3