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

Systemtic Name: N-(1-adamantylmethyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(1-adamantylmethyl)-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(CC(=O)NCC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H27N3O3S/c1-24(28(26,27)19-4-2-15(12-22)3-5-19)13-20(25)23-14-21-9-16-6-17(10-21)8-18(7-16)11-21/h2-5,16-18H,6-11,13-14H2,1H3,(H,23,25)