4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-yl-ethyl]benzamide Openeye Name: 4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridyl)ethyl]benzamide CAS Name: 4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide Traditional Name: 4-tert-butyl-N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridyl)ethyl]benzamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC[C@H](C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H28N2O4S/c1-25(2,3)20-9-7-18(8-10-20)24(28)27-17-23(19-6-5-15-26-16-19)32(29,30)22-13-11-21(31-4)12-14-22/h5-16,23H,17H2,1-4H3,(H,27,28)/t23-/m1/s1