N-[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-6-chloranyl-N-cyclopentyl-pyridine-3-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-6-chloranyl-N-cyclopentyl-pyridine-3-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-2-oxo-1-(3-pyridyl)ethyl]-6-chloro-N-cyclopentyl-pyridine-3-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-2-oxo-1-(3-pyridinyl)ethyl]-6-chloro-N-cyclopentyl-3-pyridinecarboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-2-oxo-1-pyridin-3-ylethyl]-6-chloro-N-cyclopentylpyridine-3-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-2-keto-1-(3-pyridyl)ethyl]-6-chloro-N-cyclopentyl-nicotinamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CN=CC=C1)N(C2CCCC2)C(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CN=CC=C1)N(C2CCCC2)C(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN4O2/c1-22(2,3)26-20(28)19(15-7-6-12-24-13-15)27(17-8-4-5-9-17)21(29)16-10-11-18(23)25-14-16/h6-7,10-14,17,19H,4-5,8-9H2,1-3H3,(H,26,28)/t19-/m0/s1