1-(1-adamantylmethyl)-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-(1-adamantylmethyl)-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-(1-adamantylmethyl)-3-[(4-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-(1-adamantylmethyl)-3-[[4-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-(1-adamantylmethyl)-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(1-adamantylmethyl)-3-(4-morpholinosulfonylbenzyl)urea Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H33N3O4S/c27-22(25-16-23-12-18-9-19(13-23)11-20(10-18)14-23)24-15-17-1-3-21(4-2-17)31(28,29)26-5-7-30-8-6-26/h1-4,18-20H,5-16H2,(H2,24,25,27)