1-[(4-methoxyphenyl)methylamino]-4-phenylmethoxy-thioxanthen-9-one

Systemtic Name: 1-[(4-methoxyphenyl)methylamino]-4-phenylmethoxy-thioxanthen-9-one Openeye Name: 4-benzyloxy-1-[(4-methoxyphenyl)methylamino]thioxanthen-9-one CAS Name: 1-[(4-methoxyphenyl)methylamino]-4-phenylmethoxy-9-thioxanthenone IUPAC Name: 1-[(4-methoxyphenyl)methylamino]-4-phenylmethoxythioxanthen-9-one Traditional Name: 4-benzoxy-1-(p-anisylamino)thioxanthen-9-one Formula: C28H23NO3S MolecularWeight: 453.55212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=C3C(=C(C=C2)OCC4=CC=CC=C4)SC5=CC=CC=C5C3=O

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=C3C(=C(C=C2)OCC4=CC=CC=C4)SC5=CC=CC=C5C3=O

InChI

InChI=1S/C28H23NO3S/c1-31-21-13-11-19(12-14-21)17-29-23-15-16-24(32-18-20-7-3-2-4-8-20)28-26(23)27(30)22-9-5-6-10-25(22)33-28/h2-16,29H,17-18H2,1H3