2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(propan-2-ylideneamino)ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(propan-2-ylideneamino)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(isopropylideneamino)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(propan-2-ylideneamino)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(propan-2-ylideneamino)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(isopropylideneamino)acetamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN(C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C)C

Isomeric SMILES

CC(=NNC(=O)CN(C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C)C

InChI

InChI=1S/C22H31N3O3S/c1-15(2)23-24-21(26)14-25(29(3,27)28)20-6-4-19(5-7-20)22-11-16-8-17(12-22)10-18(9-16)13-22/h4-7,16-18H,8-14H2,1-3H3,(H,24,26)