3-(1-adamantylcarbamoyl)-1-(4-methylphenyl)-1-methylsulfonyl-urea

Systemtic Name: 3-(1-adamantylcarbamoyl)-1-(4-methylphenyl)-1-methylsulfonyl-urea Openeye Name: 3-(1-adamantylcarbamoyl)-1-methylsulfonyl-1-(p-tolyl)urea CAS Name: 3-[(1-adamantylamino)-oxomethyl]-1-(4-methylphenyl)-1-methylsulfonylurea IUPAC Name: 3-(1-adamantylcarbamoyl)-1-(4-methylphenyl)-1-methylsulfonylurea Traditional Name: 3-(1-adamantylcarbamoyl)-1-mesyl-1-(p-tolyl)urea Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C

InChI

InChI=1S/C20H27N3O4S/c1-13-3-5-17(6-4-13)23(28(2,26)27)19(25)21-18(24)22-20-10-14-7-15(11-20)9-16(8-14)12-20/h3-6,14-16H,7-12H2,1-2H3,(H2,21,22,24,25)