1-(1-adamantyl)-3-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]urea Openeye Name: 1-(1-adamantyl)-3-[3-(4-isopropylpiperazin-1-yl)sulfonylphenyl]urea CAS Name: 1-(1-adamantyl)-3-[3-[(4-propan-2-yl-1-piperazinyl)sulfonyl]phenyl]urea IUPAC Name: 1-(1-adamantyl)-3-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]urea Traditional Name: 1-(1-adamantyl)-3-[3-(4-isopropylpiperazino)sulfonylphenyl]urea Formula: C24H36N4O3S MolecularWeight: 460.63264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H36N4O3S/c1-17(2)27-6-8-28(9-7-27)32(30,31)22-5-3-4-21(13-22)25-23(29)26-24-14-18-10-19(15-24)12-20(11-18)16-24/h3-5,13,17-20H,6-12,14-16H2,1-2H3,(H2,25,26,29)