6-(tert-butylsulfonylmethyl)-4-oxidanylidene-7-pyridin-4-yl-3-(1,3-thiazol-4-ylmethyl)heptanamide

Systemtic Name: 6-(tert-butylsulfonylmethyl)-4-oxidanylidene-7-pyridin-4-yl-3-(1,3-thiazol-4-ylmethyl)heptanamide Openeye Name: 6-(tert-butylsulfonylmethyl)-4-oxo-7-(4-pyridyl)-3-(thiazol-4-ylmethyl)heptanamide CAS Name: 6-(tert-butylsulfonylmethyl)-4-oxo-7-pyridin-4-yl-3-(4-thiazolylmethyl)heptanamide IUPAC Name: 6-(tert-butylsulfonylmethyl)-4-oxo-7-pyridin-4-yl-3-(1,3-thiazol-4-ylmethyl)heptanamide Traditional Name: 6-(tert-butylsulfonylmethyl)-4-keto-7-(4-pyridyl)-3-(thiazol-4-ylmethyl)enanthamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)CC(CC1=CC=NC=C1)CC(=O)C(CC2=CSC=N2)CC(=O)N

Isomeric SMILES

CC(C)(C)S(=O)(=O)CC(CC1=CC=NC=C1)CC(=O)C(CC2=CSC=N2)CC(=O)N

InChI

InChI=1S/C21H29N3O4S2/c1-21(2,3)30(27,28)13-16(8-15-4-6-23-7-5-15)9-19(25)17(11-20(22)26)10-18-12-29-14-24-18/h4-7,12,14,16-17H,8-11,13H2,1-3H3,(H2,22,26)