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

Systemtic Name: 1-(2,4-dimethoxyphenyl)-3-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-(2,4-dimethoxyphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea CAS Name: 1-(2,4-dimethoxyphenyl)-3-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]urea IUPAC Name: 1-(2,4-dimethoxyphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-(2,4-dimethoxyphenyl)-3-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]urea Formula: C33H32N4O5 MolecularWeight: 564.63098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)OC

InChI

InChI=1S/C33H32N4O5/c1-40-24-15-16-27(30(21-24)41-2)35-33(39)34-22-11-13-23(14-12-22)36-17-19-37(20-18-36)32(38)31-25-7-3-5-9-28(25)42-29-10-6-4-8-26(29)31/h3-16,21,31H,17-20H2,1-2H3,(H2,34,35,39)