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

Systemtic Name: 1-butyl-3-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-butyl-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea CAS Name: 1-butyl-3-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]urea IUPAC Name: 1-butyl-3-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-butyl-3-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]urea Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C29H32N4O3/c1-2-3-16-30-29(35)31-21-12-14-22(15-13-21)32-17-19-33(20-18-32)28(34)27-23-8-4-6-10-25(23)36-26-11-7-5-9-24(26)27/h4-15,27H,2-3,16-20H2,1H3,(H2,30,31,35)