N-cycloheptyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-cycloheptyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cycloheptyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cycloheptyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cycloheptyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cycloheptyl-1-(2-ethylphenyl)-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NC3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NC3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C22H33N3O4S/c1-4-17-11-9-10-14-19(17)25-20(26)15-24(30(3,28)29)16-22(25,2)21(27)23-18-12-7-5-6-8-13-18/h9-11,14,18H,4-8,12-13,15-16H2,1-3H3,(H,23,27)