N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-ethyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-ethyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-ethyl-acetamide CAS Name: N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methylamino]-N-ethylacetamide IUPAC Name: N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methylamino]-N-ethylacetamide Traditional Name: N-(1-adamantyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-ethyl-acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)C#N)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(C(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)C#N)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29N3O3S/c1-3-25(22-11-17-8-18(12-22)10-19(9-17)13-22)21(26)15-24(2)29(27,28)20-6-4-16(14-23)5-7-20/h4-7,17-19H,3,8-13,15H2,1-2H3