1-(2,6-dimethylphenyl)-3-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]urea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-(2,6-dimethylphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea CAS Name: 1-(2,6-dimethylphenyl)-3-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]urea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-(2,6-dimethylphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]urea Formula: C33H32N4O3 MolecularWeight: 532.63218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C33H32N4O3/c1-22-8-7-9-23(2)31(22)35-33(39)34-24-14-16-25(17-15-24)36-18-20-37(21-19-36)32(38)30-26-10-3-5-12-28(26)40-29-13-6-4-11-27(29)30/h3-17,30H,18-21H2,1-2H3,(H2,34,35,39)